[ CAS No. 5154-01-8 ] {[proInfo.proName]}

Name: 5154-01-8|5-Hydroxypyridin-2(1H)-one|98%
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SKU: A145230
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Quality Control of [ 5154-01-8 ]

COA NMR CNMR HPLC LC-MS

Related Doc. of [ 5154-01-8 ]

SDS Specification

Alternatived Products of [ 5154-01-8 ]

Product Details of [ 5154-01-8 ]

CAS No. :	5154-01-8	MDL No. :	MFCD20442000
Formula :	C₅H₅NO₂	Boiling Point :	-
Linear Structure Formula :	-	InChI Key :	CHGPEDOMXOLANF-UHFFFAOYSA-N
M.W :	111.10	Pubchem ID :	99456
Synonyms :

Calculated chemistry of [ 5154-01-8 ]

Physicochemical Properties

Num. heavy atoms :	8
Num. arom. heavy atoms :	6
Fraction Csp3 :	0.0
Num. rotatable bonds :	0
Num. H-bond acceptors :	2.0
Num. H-bond donors :	2.0
Molar Refractivity :	29.09
TPSA :	53.09 Å²

Pharmacokinetics

GI absorption :	High
BBB permeant :	No
P-gp substrate :	No
CYP1A2 inhibitor :	No
CYP2C19 inhibitor :	No
CYP2C9 inhibitor :	No
CYP2D6 inhibitor :	No
CYP3A4 inhibitor :	No
Log Kp (skin permeation) :	-7.28 cm/s

Lipophilicity

Log Po/w (iLOGP) :	0.8
Log Po/w (XLOGP3) :	-0.43
Log Po/w (WLOGP) :	0.08
Log Po/w (MLOGP) :	-0.4
Log Po/w (SILICOS-IT) :	1.11
Consensus Log Po/w :	0.23

Druglikeness

Lipinski :	0.0
Ghose :	None
Veber :	0.0
Egan :	0.0
Muegge :	1.0
Bioavailability Score :	0.55

Water Solubility

Log S (ESOL) :	-0.81
Solubility :	17.1 mg/ml ; 0.154 mol/l
Class :	Very soluble
Log S (Ali) :	-0.22
Solubility :	67.0 mg/ml ; 0.603 mol/l
Class :	Very soluble
Log S (SILICOS-IT) :	-1.29
Solubility :	5.63 mg/ml ; 0.0507 mol/l
Class :	Soluble

Medicinal Chemistry

PAINS :	0.0 alert
Brenk :	0.0 alert
Leadlikeness :	1.0
Synthetic accessibility :	1.42

Safety of [ 5154-01-8 ]

Signal Word:	Warning	Class:	N/A
Precautionary Statements:	P261-P280-P305+P351+P338	UN#:	N/A
Hazard Statements:	H302-H315-H319-H332-H335	Packing Group:	N/A
GHS Pictogram:

Application In Synthesis of [ 5154-01-8 ]

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

Upstream synthesis route of [ 5154-01-8 ]
Downstream synthetic route of [ 5154-01-8 ]

[ 5154-01-8 ] Synthesis Path-Upstream 1~13

1
[ 15873-27-5 ]
[ 5154-01-8 ]
[ 110-15-6 ]

Reference： [1] Journal of Biological Chemistry, 2014, vol. 289, # 42, p. 29158 - 29170

2
[ 15873-27-5 ]
[ 5154-01-8 ]

Reference： [1] Journal of Biological Chemistry, 2014, vol. 289, # 42, p. 29158 - 29170

3
[ 142-08-5 ]
[ 5154-01-8 ]

Reference： [1] Journal of the American Chemical Society, 1958, vol. 80, p. 3717

4
[ 51834-97-0 ]
[ 5154-01-8 ]

Reference： [1] Journal of the American Chemical Society, 1947, vol. 69, p. 1806

5
[ 99970-14-6 ]
[ 5154-01-8 ]

Reference： [1] Journal of the American Chemical Society, 1959, vol. 81, p. 6049,6053

6
[ 109-00-2 ]
[ 5154-01-8 ]

Reference： [1] Monatshefte fuer Chemie, 1897, vol. 18, p. 613
[2] Rikagaku Kenkyusho Iho, 1939, vol. 18, p. 177[3] Bl.Inst.phys.chem.Res.Abstr.Tokyo, 1939, vol. 12, p. 9[4] Chem. Zentralbl., 1939, vol. 110, # I, p. 4191

7
[ 98-01-1 ]
[ 109-00-2 ]
[ 5154-01-8 ]

Reference： [1] Rikagaku Kenkyusho Iho, 1939, vol. 18, p. 177[2] Bl.Inst.phys.chem.Res.Abstr.Tokyo, 1939, vol. 12, p. 9[3] Chem. Zentralbl., 1939, vol. 110, # I, p. 4191

8
[ 408338-50-1 ]
[ 5154-01-8 ]

Reference： [1] Recueil des Travaux Chimiques des Pays-Bas, 1950, vol. 69, p. 673,690

9
[ 98-01-1 ]
[ 5154-01-8 ]

Reference： [1] Rikagaku Kenkyusho Iho, 1939, vol. 18, p. 177[2] Bl.Inst.phys.chem.Res.Abstr.Tokyo, 1939, vol. 12, p. 9[3] Chem. Zentralbl., 1939, vol. 110, # I, p. 4191

10
[ 5154-01-8 ]
[ 19365-07-2 ]
[ 52065-78-8 ]

Reference： [1] Archiv der Pharmazie (Weinheim, Germany), 1984, vol. 317, # 4, p. 304 - 306

11
[ 5154-01-8 ]
[ 19365-07-2 ]

Reference： [1] Archiv der Pharmazie, 1983, vol. 316, # 8, p. 719 - 723

12
[ 5154-01-8 ]
[ 19365-07-2 ]
[ 52065-78-8 ]

Reference： [1] Archiv der Pharmazie (Weinheim, Germany), 1984, vol. 317, # 4, p. 304 - 306

13
[ 5154-01-8 ]
[ 52065-78-8 ]

Reference： [1] Archiv der Pharmazie, 1983, vol. 316, # 8, p. 719 - 723
[2] Archiv der Pharmazie (Weinheim, Germany), 1984, vol. 317, # 4, p. 304 - 306

[ 5154-01-8 ] Synthesis Path-Downstream 1~31

1
[ 109-00-2 ]
[ 5154-01-8 ]

Reference： [1]Monatshefte fur Chemie,1897,vol. 18,p. 613
[2]Rikagaku Kenkyusho Iho,1939,vol. 18,p. 177
Bl.Inst.phys.chem.Res.Abstr.Tokyo,1939,vol. 12,p. 9
Chemisches Zentralblatt,1939,vol. 110,p. 4191

2
[ 98-01-1 ]
[ 109-00-2 ]
[ 5154-01-8 ]

Reference： [1]Rikagaku Kenkyusho Iho,1939,vol. 18,p. 177
Bl.Inst.phys.chem.Res.Abstr.Tokyo,1939,vol. 12,p. 9
Chemisches Zentralblatt,1939,vol. 110,p. 4191

3
[ 142-08-5 ]
[ 5154-01-8 ]

Reference： [1]Journal of the American Chemical Society,1958,vol. 80,p. 3717

4
[ 5154-01-8 ]
[ 108-24-7 ]
[ 99358-18-6 ]

Reference： [1]Recueil des Travaux Chimiques des Pays-Bas,1950,vol. 69,p. 673,690

5
[ 51834-97-0 ]
[ 5154-01-8 ]

Reference： [1]Journal of the American Chemical Society,1947,vol. 69,p. 1806

6
[ 99970-14-6 ]
[ 5154-01-8 ]

Reference： [1]Journal of the American Chemical Society,1959,vol. 81,p. 6049,6053

7
[ 408338-50-1 ]
[ 5154-01-8 ]

Reference： [1]Recueil des Travaux Chimiques des Pays-Bas,1950,vol. 69,p. 673,690

8
[ 5154-01-8 ]
[ 65018-90-8 ]
[ 129421-78-9 ]

Reference： [1]Journal of Medicinal Chemistry,1990,vol. 33,p. 2759-2767

9
[ 5154-01-8 ]
[ 19365-07-2 ]
[ 52065-78-8 ]

Reference： [1]Archiv der Pharmazie,1984,vol. 317,p. 304 - 306

10
[ 5154-01-8 ]
[ 52065-78-8 ]

Reference： [1]Archiv der Pharmazie,1983,vol. 316,p. 719 - 723
[2]Archiv der Pharmazie,1984,vol. 317,p. 304 - 306

12
[ 5154-01-8 ]
[ 7664-93-9 ]
manganese dioxide [ No CAS ]
pyridine-2,5-dione [ No CAS ]

Reference： [1]Monatshefte fur Chemie,1897,vol. 18,p. 613

14
[ 59-67-6 ]
extracts of pseudomonas fluorescence [ No CAS ]
[ 5154-01-8 ]
[ 5006-66-6 ]

Reference： [1]Biochemical Journal,1955,vol. 60,p. 303,306

15
[ 5154-01-8 ]
[ 7697-37-2 ]
[ 144-62-7 ]

Reference： [1]Monatshefte fur Chemie,1897,vol. 18,p. 613

16
[ 5154-01-8 ]
[ 617-52-7 ]
dimethyl 2-((4-hydroxy-2-oxo-1-pyridyl)methyl)butanedioate [ No CAS ]

Reference： [1]Tetrahedron,2003,vol. 59,p. 2177 - 2184

17
[ 5154-01-8 ]
manganese dioxide [ No CAS ]
4-hydroxy-1-(4-hydroxy-2-hydroxymethylbutyl)pyridin-2-one [ No CAS ]

Reference： [1]Tetrahedron,2003,vol. 59,p. 2177 - 2184

18
[ 5154-01-8 ]
[ 19365-07-2 ]

Reference： [1]Archiv der Pharmazie,1983,vol. 316,p. 719 - 723

19
[ 5154-01-8 ]
[ 5451-09-2 ]

Reference： [1]Archiv der Pharmazie,1984,vol. 317,p. 304 - 306
[2]Archiv der Pharmazie,1984,vol. 317,p. 304 - 306

20
[ 98-01-1 ]
[ 5154-01-8 ]

Reference： [1]Rikagaku Kenkyusho Iho,1939,vol. 18,p. 177
Bl.Inst.phys.chem.Res.Abstr.Tokyo,1939,vol. 12,p. 9
Chemisches Zentralblatt,1939,vol. 110,p. 4191

21
[ 5154-01-8 ]
[ 350-46-9 ]
[ 630125-63-2 ]

Yield	Reaction Conditions	Operation in experiment
	With caesium carbonate; In 1-Methylpyrrolidine; at 90℃; for 18h;	A suspension of <strong>[5154-01-8]2,5-dihydroxy-pyridine</strong> (4.65 g, 41.9 [MMOL),] 4-fluoro-nitrobenzene (2.22 ml, 21 [MMOL)] and [CS2CO3] (13.7 g, 41.9 [MMOL)] in N-methyl-pyrrolidine (60 mi) is stirred for 18 h at 90 [C] under N2-atmosphere. The reaction mixture is diluted with water and AcOEt, the aqueous layer separated off and extracted twice with AcOEt. The organic phases are washed with a [NAHC03] solution and brine, dried [(NA2SO4)] and partially concentrated. Thereby the title compound crystallizes and can be filtered off and washed with AcOEt: m. p.: 214-217 [C] [;'H-NMR (DMSO-D6)] : 11.6 (s, HN), 8.22 (d, 2H), 7.57 (d, [1H),] 7.43 (dd, [1H),] 6.14 (d, 2H), 6.46 (d, [1 H).]

Reference： [1]Patent: WO2003/99771,2003,A2 .Location in patent: Page 103

22
[ 5154-01-8 ]
[ 573675-25-9 ]
[ 74-88-4 ]
[ 1065607-88-6 ]

Yield	Reaction Conditions	Operation in experiment
54%		To a solution of <strong>[5154-01-8]pyridine-2,5-diol</strong> (1.Og, 9.0 mmol) in dimethylforrnamide (150 mL) at 0 0C was added sodium hydride (60% dispersion in mineral <n="80"/>oil, 0.3Og5 9.0 mmol) in portions, and the reaction stirred at 0 C for 1 hour. To this reaction was added 5-bromo-3-nitropicolinonitrile (2.05g, 9.00 mmol) and the reaction stirred overnight at ambient temperature. Sodium hydride (60% dispersion in mineral oil, 0.3Og, 9.0 mmol) was added to the reaction mixture in portions, followed by methyl iodide (2.56g, 18.00 mmol), and the reaction was stirred at ambient temperature for 3 hours. The reaction was poured into water and the aqueous layer extracted with ethyl acetate. The organics were washed with IN HCl, IM NaOH, water, brine, dried over magnesium sulfate and concentrated in vacuo. The material purified over silica gel (2% ethyl acetate/dichloromethane) to afford 5-bromo-3-(l-methyl-6-oxo-l56-dihydropyridin-3- yloxy)picolinomtrile (1.5g, 54%).

Reference： [1]Patent: WO2008/118718,2008,A2 .Location in patent: Page/Page column 78-79

23
[ 15873-27-5 ]
[ 5154-01-8 ]
[ 110-15-6 ]

Yield	Reaction Conditions	Operation in experiment
	With beta-nicotinamide adenine dinucleotide, reduced dipotassium salt; recombinant His6-tagged 6-hydroxy-3-succinoyl-pyridine 3-monooxygenase from Pseudomonas putida S16; FAD; oxygen; In aq. buffer; at 25℃;pH 8.0;Enzymatic reaction;Mechanism; Catalytic behavior;	To test the in vitro activity of His-HspB, HSP and NADH were mixed with the recombinant enzyme in air-saturated 20 mM Tris-HCl buffer (pH 8.0) at 25 C. The decrease in absorbance at 340 nm, which was monitored by using a UV-2550 spectrophotometer (Shimadzu, Kyoto, Japan)or a 96-well plate reader (VictorTM X3, 2030 Multilabel Reader, PerkinElmer Life Sciences), was used to calculate the enzymeactivity of HspB. The activity of His-HspB with 3-succinoylpyridine (SP) was determined under the same conditions. In some experiments His-HspB powder was used, obtained by using vacuum freeze-drying methods.

Reference： [1]Journal of Biological Chemistry,2014,vol. 289,p. 29158 - 29170

24
[ 15873-27-5 ]
[ 5154-01-8 ]
succinic acid [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	With beta-nicotinamide adenine dinucleotide, reduced dipotassium salt; recombinant His6-tagged 6-hydroxy-3-succinoyl-pyridine 3-monooxygenase from Pseudomonas putida S16; FAD; oxygen; 18O-labeled water; In aq. buffer; at 25℃;pH 8.0;Enzymatic reaction;Mechanism; Catalytic behavior;	To test the in vitro activity of His-HspB, HSP and NADH were mixed with the recombinant enzyme in air-saturated 20 mM Tris-HCl buffer (pH 8.0) at 25 C. The decrease in absorbance at 340 nm, which was monitored by using a UV-2550 spectrophotometer (Shimadzu, Kyoto, Japan)or a 96-well plate reader (VictorTM X3, 2030 Multilabel Reader, PerkinElmer Life Sciences), was used to calculate the enzymeactivity of HspB. The activity of His-HspB with 3-succinoylpyridine (SP) was determined under the same conditions. In some experiments His-HspB powder was used, obtained by using vacuum freeze-drying methods.

Reference： [1]Journal of Biological Chemistry,2014,vol. 289,p. 29158 - 29170

25
[ 5154-01-8 ]
[ 1194-02-1 ]
4-((6-oxo-1,6-dihydropyridin-3-yl)oxy)benzonitrile [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
49.7%	With potassium carbonate; In N,N-dimethyl-formamide; at 110℃;	A 50 mL flask was charged with <strong>[5154-01-8]pyridine-2,5-diol</strong> (III) (2.0 g, 18.00 mmol), 4-fluorobenzonitrile (2.18 g, 18.00 mmol), potassium carbonate (4.98 g, 36.0 mmol) and DMF (25.7 mL). The reaction was heated at 110 C overnight, and then allowed to cool to room temperature. The reaction was quenched with water (50 mL) and diluted with ethyl acetate.The layers were separated and the aqueous layer was extracted with ethyl acetate. Thecombined organic layers were washed with brine (3x). The organic layer was then dried over anhydrous sodium sulfate, filtered, and concentrated. DCM was added resulting in a brown precipitate which was collected via vacuum filtration. The wetcake was dried to give 4-((6- oxo-1,6-dihydropyridin-3-yl)oxy)benzonitrile (II) as a tan solid (2 g, 8.95 mmol, 49.7%yield). mp: 223 -226 C. ?H NMR (500 MHz, DMSO-d6) 11.66 (s, 1H), 7.86-7.76 (m,2H), 7.57 (d, J = 3.2 Hz, 1H), 7.43 (dd, J = 9.7, 3.2 Hz, 1H), 7.20 - 6.99 (m, 2H), 6.49 (d, J =9.7 Hz, 1H). ?3C NMR (126 MHz, DMSO-d6) 162.3, 161.7, 137.1, 136.9, 135.0, 129.8,120.2, 119.2, 117.2, 105.2. HRMS-ESI (mlz) [M+Hj calcd for C,2H8N202, 213.0659; found,213.0653.

Reference： [1]Patent: WO2018/94128,2018,A1 .Location in patent: Page/Page column 4; 5

26
[ 5006-66-6 ]
[ 5154-01-8 ]

Reference： [1]Biochemistry,2019,vol. 58,p. 1751 - 1763

27
[ 5154-01-8 ]
[ 16110-09-1 ]

Yield	Reaction Conditions	Operation in experiment
94.3%	With trichlorophosphate; at 140 - 145℃;Green chemistry;	Equipped with a thermometer, mechanical stirrer, a 500 ml four-necked flask with a reflux condenser was added 200 g of phosphorus oxychloride, 22.0 g (0.2 mol) of the <strong>[5154-01-8]2,5-dihydroxypyridine</strong> prepared in Example 2, and stirred at 140-145 C for 4 hours. Then, the excess phosphorus oxychloride was recovered by distillation under reduced pressure, and the residue was slowly poured into 300 g of ice water, thoroughly stirred, and then neutralized to a pH of 7-9 with a 40% aqueous sodium hydroxide solution. It was extracted three times with 50 g of dichloromethane, and the organic phases were combined, washed with 30 g of brine, and dried over 5 g of anhydrous sodium sulfate. The solvent was removed by rotary evaporation to give 27.9 g of pale yellow powder, 2,5-dichloropyridine (I). The yield was 94.3%, and the liquid phase purity was 99.5%.

Reference： [1]Patent: CN109721529,2019,A .Location in patent: Paragraph 0041; 0056; 0057; 0058; 0059; 0060; 0061-0063

28
C₇H₉NO₅ [ No CAS ]
[ 5154-01-8 ]

Yield	Reaction Conditions	Operation in experiment
94%	With 5%-palladium/activated carbon; hydrogen; In ethanol; water; at 50 - 55℃; under 750.075 - 1500.15 Torr; for 4h;Autoclave;	To a 500 ml four-necked flask equipped with a stirring, thermometer, and reflux condenser, 30.5 g (0.5 mol) of nitromethane, 86.1 g (0.5 mol) of diethyl maleate, 1.8 g of DBN, were added. The reaction was stirred at 65-70 C for 5 hours and cooled to 20-25 C. The obtained reaction liquid was transferred into a 1 liter autoclave, and 400 g of ethanol and 1.2 g of palladium carbon (50 wt% aqueous) catalyst having a palladium mass content of 5% were added. After replacing the nitrogen three times, hydrogen gas was introduced to maintain a hydrogen pressure of 0.1-0.2 MPa, and the reaction was carried out at 50-55 C for 4 hours. After replacing the nitrogen three times, the catalyst was removed by filtration, and the filtrate was concentrated to dryness, and then recrystallized from 100 g of methyl tert-butyl ether to obtain 52.2 g of pale yellow solid 2,5-dihydroxypyridine (III). The liquid phase purity was 99.8%, and the product yield was 94.0%.

Reference： [1]Patent: CN109721529,2019,A .Location in patent: Paragraph 0050; 0051

29
C₈H₁₁NO₅ [ No CAS ]
[ 5154-01-8 ]

Yield	Reaction Conditions	Operation in experiment
93.6%	With 50% Raney nickel; In water; isopropyl alcohol; at 60 - 65℃; under 750.075 - 1500.15 Torr; for 4h;Autoclave;	To a 500 ml four-necked flask equipped with a stirring, thermometer, and reflux condenser, 30.5 g (0.5 mol) of nitromethane, 100.1 g (0.5 mol) of diisopropyl maleate, 1.8 g of DBU, were added. The reaction was stirred at 65-70 C for 5 hours and cooled to 20-25 C. The obtained reaction liquid was transferred into a 1 liter autoclave, and 400 g of isopropyl alcohol was added, and 8.0 g of a nickel content of 50% Raney nickel (50 wt% aqueous) catalyst was added. After replacing the nitrogen three times, hydrogen gas was introduced to maintain a hydrogen pressure of 0.1-0.2 MPa, and the reaction was carried out at 60-65 C for 4 hours. After replacing the nitrogen three times, the catalyst was removed by filtration, and the filtrate was concentrated to dryness, and then recrystallized from 100 g of methyl tert-butyl ether to obtain 52.0 g of pale yellow solid 2,5-dihydroxypyridine (III). The liquid phase purity was 99.6%, and the product yield was 93.6%.

Reference： [1]Patent: CN109721529,2019,A .Location in patent: Paragraph 0052; 0053

30
C₉H₁₃NO₅ [ No CAS ]
[ 5154-01-8 ]

Yield	Reaction Conditions	Operation in experiment
91.5%	With 50% Raney nickel; In tetrahydrofuran; water; at 60 - 65℃; under 750.075 - 1500.15 Torr; for 5h;Autoclave;	To a 500 ml four-necked flask equipped with a stirring, thermometer, and reflux condenser, 30.5 g (0.5 mol) of nitromethane, 114.1 g (0.5 mol) of di-tert-butyl maleate, 1.8 g of DBU, were added. The reaction was stirred at 65-70 C for 5 hours and cooled to 20-25 C. The obtained reaction liquid was transferred into a 1 liter autoclave, and 400 g of tetrahydrofuran was added, and 9.0 g of a nickel content of 50% Raney nickel (aqueous 50 wt%) catalyst was added. After replacing the nitrogen three times, hydrogen gas was introduced to maintain a hydrogen pressure of 0.1 to 0.2 MPa, and the reaction was carried out at 60 to 65 C for 5 hours. After replacing the nitrogen three times, the catalyst was removed by filtration, and the filtrate was concentrated to dryness, and then recrystallized from 100 g of methyl tert-butyl ether to obtain 50.8 g of pale yellow solid 2,5-dihydroxypyridine (III).The liquid phase purity was 99.7%, and the product yield was 91.5%.

Reference： [1]Patent: CN109721529,2019,A .Location in patent: Paragraph 0054; 0055

31
C₆H₇NO₅ [ No CAS ]
[ 5154-01-8 ]

Yield	Reaction Conditions	Operation in experiment
93.1%	With 5%-palladium/activated carbon; hydrogen; In methanol; water; at 50 - 55℃; under 750.075 - 1500.15 Torr; for 4h;Autoclave;	To a 500 ml four-necked flask equipped with a stirring, thermometer, and reflux condenser, 30.5 g (0.5 mol) of nitromethane, 72.0 g (0.5 mol) of dimethyl maleate, and 1.8 g of DBU were added. The reaction was stirred at 60-65 C for 5 hours and cooled to 20-25 C. The obtained reaction liquid was transferred into a 1 liter autoclave, and 400 g of methanol was added, and 1.0 g of palladium carbon (50 wt% aqueous) catalyst having a palladium mass content of 5% was added. After replacing the nitrogen three times, hydrogen gas was introduced to maintain a hydrogen pressure of 0.1-0.2 MPa, and the reaction was carried out at 50-55 C for 4 hours. After replacing the nitrogen three times, the catalyst was removed by filtration, and the filtrate was concentrated to dryness, and then recrystallized from 100 g of methyl tert-butyl ether to obtain 51.7 g of pale yellow solid 2,5-dihydroxypyridine (III). The liquid phase purity was 99.7%, and the product yield was 93.1%.

Reference： [1]Patent: CN109721529,2019,A .Location in patent: Paragraph 0048; 0049; 0064; 0065; 0067; 0068; 0070; 0071

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Ghs Precautionary Statements

Precautionary Statements-General
Code	Phrase
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P102	Keep out of reach of children.
P103	Read label before use
Prevention
Code	Phrase
P201	Obtain special instructions before use.
P202	Do not handle until all safety precautions have been read and understood.
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P211	Do not spray on an open flame or other ignition source.
P220	Keep/Store away from clothing/combustible materials.
P221	Take any precaution to avoid mixing with combustibles
P222	Do not allow contact with air.
P223	Keep away from any possible contact with water, because of violent reaction and possible flash fire.
P230	Keep wetted
P231	Handle under inert gas.
P232	Protect from moisture.
P233	Keep container tightly closed.
P234	Keep only in original container.
P235	Keep cool
P240	Ground/bond container and receiving equipment.
P241	Use explosion-proof electrical/ventilating/lighting/equipment.
P242	Use only non-sparking tools.
P243	Take precautionary measures against static discharge.
P244	Keep reduction valves free from grease and oil.
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P261	Avoid breathing dust/fume/gas/mist/vapours/spray.
P262	Do not get in eyes, on skin, or on clothing.
P263	Avoid contact during pregnancy/while nursing.
P264	Wash hands thoroughly after handling.
P265	Wash skin thouroughly after handling.
P270	Do not eat, drink or smoke when using this product.
P271	Use only outdoors or in a well-ventilated area.
P272	Contaminated work clothing should not be allowed out of the workplace.
P273	Avoid release to the environment.
P280	Wear protective gloves/protective clothing/eye protection/face protection.
P281	Use personal protective equipment as required.
P282	Wear cold insulating gloves/face shield/eye protection.
P283	Wear fire/flame resistant/retardant clothing.
P284	Wear respiratory protection.
P285	In case of inadequate ventilation wear respiratory protection.
P231 + P232	Handle under inert gas. Protect from moisture.
P235 + P410	Keep cool. Protect from sunlight.
Response
Code	Phrase
P301	IF SWALLOWED:
P304	IF INHALED:
P305	IF IN EYES:
P306	IF ON CLOTHING:
P307	IF exposed:
P308	IF exposed or concerned:
P309	IF exposed or if you feel unwell:
P310	Immediately call a POISON CENTER or doctor/physician.
P311	Call a POISON CENTER or doctor/physician.
P312	Call a POISON CENTER or doctor/physician if you feel unwell.
P313	Get medical advice/attention.
P314	Get medical advice/attention if you feel unwell.
P315	Get immediate medical advice/attention.
P320
P302 + P352	IF ON SKIN: wash with plenty of soap and water.
P321
P322
P330	Rinse mouth.
P331	Do NOT induce vomiting.
P332	IF SKIN irritation occurs:
P333	If skin irritation or rash occurs:
P334	Immerse in cool water/wrap n wet bandages.
P335	Brush off loose particles from skin.
P336	Thaw frosted parts with lukewarm water. Do not rub affected area.
P337	If eye irritation persists:
P338	Remove contact lenses, if present and easy to do. Continue rinsing.
P340	Remove victim to fresh air and keep at rest in a position comfortable for breathing.
P341	If breathing is difficult, remove victim to fresh air and keep at rest in a position comfortable for breathing.
P342	If experiencing respiratory symptoms:
P350	Gently wash with plenty of soap and water.
P351	Rinse cautiously with water for several minutes.
P352	Wash with plenty of soap and water.
P353	Rinse skin with water/shower.
P360	Rinse immediately contaminated clothing and skin with plenty of water before removing clothes.
P361	Remove/Take off immediately all contaminated clothing.
P362	Take off contaminated clothing and wash before reuse.
P363	Wash contaminated clothing before reuse.
P370	In case of fire:
P371	In case of major fire and large quantities:
P372	Explosion risk in case of fire.
P373	DO NOT fight fire when fire reaches explosives.
P374	Fight fire with normal precautions from a reasonable distance.
P376	Stop leak if safe to do so. Oxidising gases (section 2.4) 1
P377	Leaking gas fire: Do not extinguish, unless leak can be stopped safely.
P378
P380	Evacuate area.
P381	Eliminate all ignition sources if safe to do so.
P390	Absorb spillage to prevent material damage.
P391	Collect spillage. Hazardous to the aquatic environment
P301 + P310	IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.
P301 + P312	IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P301 + P330 + P331	IF SWALLOWED: Rinse mouth. Do NOT induce vomiting.
P302 + P334	IF ON SKIN: Immerse in cool water/wrap in wet bandages.
P302 + P350	IF ON SKIN: Gently wash with plenty of soap and water.
P303 + P361 + P353	IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower.
P304 + P312	IF INHALED: Call a POISON CENTER or doctor/physician if you feel unwell.
P304 + P340	IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.
P304 + P341	IF INHALED: If breathing is difficult, remove victim to fresh air and keep at rest in a position comfortable for breathing.
P305 + P351 + P338	IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
P306 + P360	IF ON CLOTHING: Rinse Immediately contaminated CLOTHING and SKIN with plenty of water before removing clothes.
P307 + P311	IF exposed: call a POISON CENTER or doctor/physician.
P308 + P313	IF exposed or concerned: Get medical advice/attention.
P309 + P311	IF exposed or if you feel unwell: call a POISON CENTER or doctor/physician.
P332 + P313	IF SKIN irritation occurs: Get medical advice/attention.
P333 + P313	IF SKIN irritation or rash occurs: Get medical advice/attention.
P335 + P334	Brush off loose particles from skin. Immerse in cool water/wrap in wet bandages.
P337 + P313	IF eye irritation persists: Get medical advice/attention.
P342 + P311	IF experiencing respiratory symptoms: call a POISON CENTER or doctor/physician.
P370 + P376	In case of fire: Stop leak if safe to Do so.
P370 + P378	In case of fire:
P370 + P380	In case of fire: Evacuate area.
P370 + P380 + P375	In case of fire: Evacuate area. Fight fire remotely due to the risk of explosion.
P371 + P380 + P375	In case of major fire and large quantities: Evacuate area. Fight fire remotely due to the risk of explosion.
Storage
Code	Phrase
P401
P402	Store in a dry place.
P403	Store in a well-ventilated place.
P404	Store in a closed container.
P405	Store locked up.
P406	Store in corrosive resistant/ container with a resistant inner liner.
P407	Maintain air gap between stacks/pallets.
P410	Protect from sunlight.
P411
P412	Do not expose to temperatures exceeding 50 oC/ 122 oF.
P413
P420	Store away from other materials.
P422
P402 + P404	Store in a dry place. Store in a closed container.
P403 + P233	Store in a well-ventilated place. Keep container tightly closed.
P403 + P235	Store in a well-ventilated place. Keep cool.
P410 + P403	Protect from sunlight. Store in a well-ventilated place.
P410 + P412	Protect from sunlight. Do not expose to temperatures exceeding 50 oC/122oF.
P411 + P235	Keep cool.
Disposal
Code	Phrase
P501	Dispose of contents/container to ...
P502	Refer to manufacturer/supplier for information on recovery/recycling

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Physical hazards
Code	Phrase
H200	Unstable explosive
H201	Explosive; mass explosion hazard
H202	Explosive; severe projection hazard
H203	Explosive; fire, blast or projection hazard
H204	Fire or projection hazard
H205	May mass explode in fire
H220	Extremely flammable gas
H221	Flammable gas
H222	Extremely flammable aerosol
H223	Flammable aerosol
H224	Extremely flammable liquid and vapour
H225	Highly flammable liquid and vapour
H226	Flammable liquid and vapour
H227	Combustible liquid
H228	Flammable solid
H229	Pressurized container: may burst if heated
H230	May react explosively even in the absence of air
H231	May react explosively even in the absence of air at elevated pressure and/or temperature
H240	Heating may cause an explosion
H241	Heating may cause a fire or explosion
H242	Heating may cause a fire
H250	Catches fire spontaneously if exposed to air
H251	Self-heating; may catch fire
H252	Self-heating in large quantities; may catch fire
H260	In contact with water releases flammable gases which may ignite spontaneously
H261	In contact with water releases flammable gas
H270	May cause or intensify fire; oxidizer
H271	May cause fire or explosion; strong oxidizer
H272	May intensify fire; oxidizer
H280	Contains gas under pressure; may explode if heated
H281	Contains refrigerated gas; may cause cryogenic burns or injury
H290	May be corrosive to metals
Health hazards
Code	Phrase
H300	Fatal if swallowed
H301	Toxic if swallowed
H302	Harmful if swallowed
H303	May be harmful if swallowed
H304	May be fatal if swallowed and enters airways
H305	May be harmful if swallowed and enters airways
H310	Fatal in contact with skin
H311	Toxic in contact with skin
H312	Harmful in contact with skin
H313	May be harmful in contact with skin
H314	Causes severe skin burns and eye damage
H315	Causes skin irritation
H316	Causes mild skin irritation
H317	May cause an allergic skin reaction
H318	Causes serious eye damage
H319	Causes serious eye irritation
H320	Causes eye irritation
H330	Fatal if inhaled
H331	Toxic if inhaled
H332	Harmful if inhaled
H333	May be harmful if inhaled
H334	May cause allergy or asthma symptoms or breathing difficulties if inhaled
H335	May cause respiratory irritation
H336	May cause drowsiness or dizziness
H340	May cause genetic defects
H341	Suspected of causing genetic defects
H350	May cause cancer
H351	Suspected of causing cancer
H360	May damage fertility or the unborn child
H361	Suspected of damaging fertility or the unborn child
H361d	Suspected of damaging the unborn child
H362	May cause harm to breast-fed children
H370	Causes damage to organs
H371	May cause damage to organs
H372	Causes damage to organs through prolonged or repeated exposure
H373	May cause damage to organs through prolonged or repeated exposure
Environmental hazards
Code	Phrase
H400	Very toxic to aquatic life
H401	Toxic to aquatic life
H402	Harmful to aquatic life
H410	Very toxic to aquatic life with long-lasting effects
H411	Toxic to aquatic life with long-lasting effects
H412	Harmful to aquatic life with long-lasting effects
H413	May cause long-lasting harmful effects to aquatic life
H420	Harms public health and the environment by destroying ozone in the upper atmosphere

[ CAS No. 5154-01-8 ] {[proInfo.proName]}

Quality Control of [ 5154-01-8 ]

Related Doc. of [ 5154-01-8 ]

Product Details of [ 5154-01-8 ]

Calculated chemistry of [ 5154-01-8 ]

Physicochemical Properties

Pharmacokinetics

Lipophilicity

Druglikeness

Water Solubility

Medicinal Chemistry

Safety of [ 5154-01-8 ]

Application In Synthesis of [ 5154-01-8 ]

[ 5154-01-8 ] Synthesis Path-Upstream 1~13

[ 5154-01-8 ] Synthesis Path-Downstream 1~31

Related Functional Groups of [ 5154-01-8 ]

Alcohols

Amides

Related Parent Nucleus of [ 5154-01-8 ]

Pyridines

Precautionary Statements-General

Prevention

Response

Storage

Disposal

Physical hazards

Health hazards

Environmental hazards

Inquiry

Related Functional Groups of
[ 5154-01-8 ]

Related Parent Nucleus of
[ 5154-01-8 ]