120277-39-6|(E)-3-(Pyridin-3-yl)prop-2-en-1-ol| Ambeed

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Quality Control of [ 120277-39-6 ] Purity: 95% SDS Specification

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Product Details of [ 120277-39-6 ]

CAS No. :	120277-39-6
Formula :	C₈H₉NO
M.W :	135.16
SMILES Code :	OC/C=C/C1=CC=CN=C1
MDL No. :	MFCD03425627
InChI Key :	RSFCHWDTMRVOJD-DUXPYHPUSA-N
Pubchem ID :	5861913

Safety of [ 120277-39-6 ]

GHS Pictogram:
Signal Word:	Warning
Hazard Statements:	H315-H319-H335
Precautionary Statements:	P261-P305+P351+P338

Application In Synthesis of [ 120277-39-6 ]

* 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.

Downstream synthetic route of [ 120277-39-6 ]

[ 120277-39-6 ] Synthesis Path-Downstream 1~35

1
[ 120277-39-6 ]
[ 5070-13-3 ]
[ 129943-30-2 ]

References: [1]Angewandte Chemie,1990,vol. 102,p. 1520 - 1522.

2
[ 81124-48-3 ]
[ 120277-39-6 ]

Yield	Reaction Conditions	Operation in experiment
		[0364] Step B: [0365] To the solution of the crude product from Step A (1.02 g, 6.3 mmol) in CH2Cl2 (50 mL) at -78° C. was added diisobutylaluminum hydride (1.0 M in CH2Cl2, 16 mL). The reaction was stirred at -78° C. for 10 min before being quenched with MeOH (5 mL) followed by 2.5 N aq. NaOH (50 mL). The mixture was extracted with CH2Cl2 (50 mL.x.2). The resulting solution was washed with sat. aq. NaCl, dried over MgSO4 and concentrated.

References: [1]Chemistry Letters,1996,p. 113 - 114.
[2]Patent: US2004/18994,2004,A1 .Location in patent: Page/Page column 57-58.

3
[ 120277-39-6 ]
[ 18162-48-6 ]
[ 174969-58-5 ]

References: [1]Chemistry Letters,1996,p. 113 - 114.

4
[ 120277-39-6 ]
[ 108-24-7 ]
[ 132376-76-2 ]

References: [1]Journal of Medicinal Chemistry,1997,vol. 40,p. 1845 - 1854.

5
[ 189637-49-8 ]
[ 120277-39-6 ]

References: [1]Journal of Medicinal Chemistry,1997,vol. 40,p. 1845 - 1854.

6
[ 120277-39-6 ]
[ 449209-03-4 ]

References: [1]European Journal of Medicinal Chemistry,1999,vol. 34,p. 177 - 190.

8
[ 120277-39-6 ]
[ 28447-15-6 ]

Yield	Reaction Conditions	Operation in experiment
42%	With manganese(IV) oxide; In dichloromethane; at 20℃; for 16.0h;	[0366] Step C: [0367] To the solution of the crude product from Step B (0.5 g, 3.8 mmol) in CH2Cl2 (20 mL) was added MnO2 (2.5 g). The mixture was stirred at room temperature for 16 h. Filtration, concentration and purification by chromatography (silica gel, 98:2 dichloromethane/methanol) gave 0.37 g (42percent) of the title compound as white solid MS134 (M+H)+.

References: [1]Tetrahedron Letters,2006,vol. 47,p. 5923 - 5926.
[2]Patent: US2004/18994,2004,A1 .Location in patent: Page/Page column 58.
[3]Chemical and Pharmaceutical Bulletin,2000,vol. 48,p. 694 - 707.

9
[ 59607-99-7 ]
[ 120277-39-6 ]

References: [1]Organic and Biomolecular Chemistry,2005,vol. 3,p. 3266 - 3268.
[2]Angewandte Chemie - International Edition,2016,vol. 55,p. 15072 - 15075.
Angew. Chem.,2016,vol. 128,p. 15296 - 15299,4.
[3]Chemical and Pharmaceutical Bulletin,2000,vol. 48,p. 694 - 707.
[4]Angewandte Chemie - International Edition,2014,vol. 53,p. 6546 - 6549.
Angew. Chem.,2014,vol. 126,p. 6664 - 6667,4.

10
[ 120277-39-6 ]
[ 34619-03-9 ]
tert-butyl (E)-3-(pyridine-3'-yl)prop-2-en-1-yl carbonate [ No CAS ]

References: [1]Organic and Biomolecular Chemistry,2005,vol. 3,p. 3266 - 3268.

11
[ 120277-39-6 ]
[ 79-22-1 ]
methyl (2E)-3-pyridine-3-ylprop-2-ene-1-yl carbonate [ No CAS ]

References: [1]Organic and Biomolecular Chemistry,2005,vol. 3,p. 3266 - 3268.
[2]Organic and Biomolecular Chemistry,2008,vol. 6,p. 3723 - 3731.

12
[ 120277-39-6 ]
[ 867154-47-0 ]

References: [1]Organic and Biomolecular Chemistry,2005,vol. 3,p. 3266 - 3268.
[2]Organic and Biomolecular Chemistry,2005,vol. 3,p. 3266 - 3268.

13
[ 120277-39-6 ]
<i>N</i>-allyl-<i>N</i>-(1-pyridin-3-yl-allyl)-formamide [ No CAS ]

References: [1]Organic and Biomolecular Chemistry,2005,vol. 3,p. 3266 - 3268.
[2]Organic and Biomolecular Chemistry,2005,vol. 3,p. 3266 - 3268.

14
[ 120277-39-6 ]
(S)-benzyl allyl(1-pyridin-3-ylprop-2-en-1-yl)carbamate [ No CAS ]

References: [1]Organic and Biomolecular Chemistry,2005,vol. 3,p. 3266 - 3268.
[2]Organic and Biomolecular Chemistry,2005,vol. 3,p. 3266 - 3268.

15
[ 120277-39-6 ]
(2R,3R)-2-(2,4-Difluorophenyl)-3-[[trans-2-[(E)-2-(pyridin-3-yl)vinyl]-1,3-dioxan-5-yl]thio]-1-(1H-1,2,4-triazol-1-yl)-2-butanol [ No CAS ]

References: [1]Chemical and Pharmaceutical Bulletin,2000,vol. 48,p. 694 - 707.

16
[ 120277-39-6 ]
[ 228271-76-9 ]

References: [1]European Journal of Medicinal Chemistry,1999,vol. 34,p. 177 - 190.

17
[ 120277-39-6 ]
Methyl-((E)-3-pyridin-3-yl-allyl)-amine [ No CAS ]

References: [1]European Journal of Medicinal Chemistry,1999,vol. 34,p. 177 - 190.

18
[ 120277-39-6 ]
(E)-N-ethyl-N-methyl-3-(3-pyridyl)-2-propenylamine [ No CAS ]

References: [1]European Journal of Medicinal Chemistry,1999,vol. 34,p. 177 - 190.

19
[ 120277-39-6 ]
Methyl-propyl-((E)-3-pyridin-3-yl-allyl)-amine [ No CAS ]

References: [1]European Journal of Medicinal Chemistry,1999,vol. 34,p. 177 - 190.

20
[ 120277-39-6 ]
3-((E)-3-Pyrrolidin-1-yl-propenyl)-pyridine [ No CAS ]

References: [1]European Journal of Medicinal Chemistry,1999,vol. 34,p. 177 - 190.

21
[ 120277-39-6 ]
[ 157401-05-3 ]

References: [1]Journal of Medicinal Chemistry,1997,vol. 40,p. 1845 - 1854.

22
[ 19337-97-4 ]
[ 120277-39-6 ]

Yield	Reaction Conditions	Operation in experiment
	With 4-methyl-morpholine; sodium borohydrid; isobutyl chloroformate; In 1,2-dimethoxyethane; water;	PREPARATION 5 Isobutyl chloroformate (4.4 ml) was added dropwise to a suspension of (E)-3-(3-pyridyl)acrylic acid (5.0 g) and N-methylmorpholine (4.05 ml) in 1,2-dimethoxyethane (50 ml) under -18° C. After being stirred at the same temperature for 0.5 hour, a solution of sodium borohydride (1.86 g) in water (10 ml) was added to the mixture all at once. The resulting mixture was poured into water and extracted with ethyl acetate. The extract was washed with brine and dried over magnesium sulfate, and evaporated under reduced pressure. The residue was purified by column chromatography on silica gel using a mixed solvent of hexane and ethyl acetate as eluent. The fractions containing the objective compound were collected and evaporated under reduced pressure to give (E)-3-(3-pyridyl)-2-propen-1-ol (1.0 g) as an oil. NMR (CDCl3, delta): 4.40 (2H, d, J=4.0Hz), 6.52 (1H, dt, J=4.0, 16.1Hz, trans), 6.65 (1H, d, J=16.1Hz, trans), 7.45 (1H, dd, J=5.6, 8.0Hz), 7.89 (1H, d, J=8.0Hz), 8.44 (1H, d, J=15.6Hz), 8.58 (1H, s)

References: [1]Journal of Medicinal Chemistry,1997,vol. 40,p. 1845 - 1854.
[2]Patent: US2003/114668,2003,A1 .

23
[ 120277-39-6 ]
[ 174969-59-6 ]

References: [1]Chemistry Letters,1996,p. 113 - 114.

24
[ 120277-39-6 ]
(3R,5S,12bR)-5-(tert-Butyl-dimethyl-silanyloxymethyl)-3-ethyl-6-hydroxy-5,12b-dihydro-3H-11-oxa-12a-aza-benzo[def]chrysen-12-one [ No CAS ]

References: [1]Chemistry Letters,1996,p. 113 - 114.

25
[ 120277-39-6 ]
(3R,5S,12bR)-5-(tert-Butyl-dimethyl-silanyloxymethyl)-3-ethyl-6-methoxy-5,12b-dihydro-3H-11-oxa-12a-aza-benzo[def]chrysen-12-one [ No CAS ]

References: [1]Chemistry Letters,1996,p. 113 - 114.

26
[ 120277-39-6 ]
(4R,6S,12bR)-6-(tert-Butyl-dimethyl-silanyloxymethyl)-4-ethyl-7,12-dioxo-6,7,12,12b-tetrahydro-4H-naphtho[2,3-h]quinoline-1-carboxylic acid phenyl ester [ No CAS ]

References: [1]Chemistry Letters,1996,p. 113 - 114.

27
[ 120277-39-6 ]
[ 129943-34-6 ]

References: [1]Angewandte Chemie,1990,vol. 102,p. 1520 - 1522.

28
[ 120277-39-6 ]
[ 129943-31-3 ]

References: [1]Angewandte Chemie,1990,vol. 102,p. 1520 - 1522.

29
[ 120277-39-6 ]
[ 129943-40-4 ]

References: [1]Angewandte Chemie,1990,vol. 102,p. 1520 - 1522.

30
[ 120277-39-6 ]
[ 129943-35-7 ]

References: [1]Angewandte Chemie,1990,vol. 102,p. 1520 - 1522.

31
[ 120277-39-6 ]
[ 129943-39-1 ]

References: [1]Angewandte Chemie,1990,vol. 102,p. 1520 - 1522.

32
[ 120277-39-6 ]
[ 129943-36-8 ]

References: [1]Angewandte Chemie,1990,vol. 102,p. 1520 - 1522.

33
[ 120277-39-6 ]
[ 129943-38-0 ]

References: [1]Angewandte Chemie,1990,vol. 102,p. 1520 - 1522.

34
[ 120277-39-6 ]
[ 129943-56-2 ]

References: [1]Angewandte Chemie,1990,vol. 102,p. 1520 - 1522.

35
[ 120277-39-6 ]
[ 129943-33-5 ]

References: [1]Angewandte Chemie,1990,vol. 102,p. 1520 - 1522.

Historical Records

Technical Information

• Appel Reaction • Buchwald-Hartwig C-N Bond and C-O Bond Formation Reactions • Chugaev Reaction • Corey-Kim Oxidation • Dess-Martin Oxidation • Hydride Reductions • Jones Oxidation • Martin's Sulfurane Dehydrating Reagent • Mitsunobu Reaction • Moffatt Oxidation • Oxidation of Alcohols by DMSO • Preparation of Alcohols • Preparation of Amines • Reactions of Alcohols • Reactions with Organometallic Reagents • Ritter Reaction • Sharpless Olefin Synthesis • Swern Oxidation

Related Functional Groups of
[ 120277-39-6 ]

Alkenyls

A385192 [1126-74-5]

3-(Pyridin-3-yl)acrylic acid

Similarity: 0.84

A339537 [19337-97-4]

trans-3-(3-Pyridyl)acrylic acid

Similarity: 0.84

A197589 [13362-78-2]

(E)-1,2-Di(pyridin-4-yl)ethene

Similarity: 0.74

A108631 [167837-43-6]

(E)-3-(6-Aminopyridin-3-yl)acrylic acid

Similarity: 0.73

A275095 [5337-79-1]

3-(Pyridin-4-yl)acrylic acid

Similarity: 0.73

Alcohols

A118323 [102074-19-1]

(5-Methylpyridin-3-yl)methanol

Similarity: 0.90

A149950 [38070-80-3]

Pyridine-3,4-diyldimethanol

Similarity: 0.85

A345889 [100-55-0]

3-Pyridinemethanol

Similarity: 0.84

A103571 [201286-63-7]

(3,5-Dimethylpyridin-4-yl)methanol

Similarity: 0.83

A197208 [1159511-15-5]

8-Hydroxymethylisoquinoline

Similarity: 0.82

Related Parent Nucleus of
[ 120277-39-6 ]

Pyridines

A118323 [102074-19-1]

(5-Methylpyridin-3-yl)methanol

Similarity: 0.90

A149950 [38070-80-3]

Pyridine-3,4-diyldimethanol

Similarity: 0.85

A345889 [100-55-0]

3-Pyridinemethanol

Similarity: 0.84

A385192 [1126-74-5]

3-(Pyridin-3-yl)acrylic acid

Similarity: 0.84

A339537 [19337-97-4]

trans-3-(3-Pyridyl)acrylic acid

Similarity: 0.84

Precautionary Statements-General
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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.
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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.
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P332 + P313	IF SKIN irritation occurs: Get medical advice/attention.
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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.
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H200	Unstable explosive
H201	Explosive; mass explosion hazard
H202	Explosive; severe projection hazard
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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
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H260	In contact with water releases flammable gases which may ignite spontaneously
H261	In contact with water releases flammable gas
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Health hazards
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H370	Causes damage to organs
H371	May cause damage to organs
H372	Causes damage to organs through prolonged or repeated exposure
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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

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CAS No.: 120277-39-6

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