864448-41-9|tert-Butyl 3-oxa-7,9-diazabicyclo[3.3.1]nonane-7-carboxylate| Ambeed

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Quality Control of [ 864448-41-9 ] Purity: 95% SDS Specification

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Product Details of [ 864448-41-9 ]

CAS No. :	864448-41-9
Formula :	C₁₁H₂₀N₂O₃
M.W :	228.29
SMILES Code :	O=C(N1CC2COCC(N2)C1)OC(C)(C)C
MDL No. :	MFCD12198828
InChI Key :	SYYVJJWPPNEPGD-UHFFFAOYSA-N
Pubchem ID :	53415349

Safety of [ 864448-41-9 ]

GHS Pictogram:
Signal Word:	Warning
Hazard Statements:	H302-H315-H319-H335
Precautionary Statements:	P261-P305+P351+P338

Application In Synthesis of [ 864448-41-9 ]

* 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 [ 864448-41-9 ]

[ 864448-41-9 ] Synthesis Path-Downstream 1~35

1
[ 864448-41-9 ]
[ 352-11-4 ]
[ 864448-44-2 ]

Yield	Reaction Conditions	Operation in experiment
67%	With sodium hydrogencarbonate; In ethanol; for 1.5h;Heating / reflux;	k) 9-(4-Fiuorobenzvi)-3-oxa-7.9-diazabicvc)or3.3.11nonane-7-carboxviic acid tert-butyl ester; 3-Oxa-7,9-diazabicyclo[3.3.1]nonane-7-carboxylic acid tert-butyl ester (97 mg; 0.4 mmol) in EtOH (4 ml) is combined with 4-fluorbenzylchlorid (0.051 ml; 0.4 mmol) and NaHC03 (179 mg; 2.1 mmol) and refluxed for 1.5 h. The reaction mixture is evaporated, taken up in TBME, filtered and purifed via chromatography (TBME/hexanes 2/8 to 3/7) to yield the title compound as colorless crystals (95 mg; 67 %) 1 H-NMR (400MHz; DMSO-d6), No. (ppm) : 1.40 (s, 2.50 (s, 3.28(d, 1 H); 3.42 (d, 1H) ; 3.68 (dd, 2H) ; 3.73-3.88 (m, 4H) ; 3.91 (s, 2H) ; 7.13 (t, 2H) ; 7.41 (dd, 2H). MS (m/z) ES+: 337.2 (MH+,

References: [1]Patent: WO2005/103054,2005,A2 .Location in patent: Page/Page column 142.

2
[ 864448-40-8 ]
[ 864448-41-9 ]

Yield	Reaction Conditions	Operation in experiment
74%		i) 3-Oxa-7,9-diazabicvclo[3.3.llnonane-7-carboxylic acid tert-butvl ester; 9-Benzyl-3-oxa-7,9-diazabicyclo[3.3.1]nonane-7-carboxylic acid tert-butyl ester (100 mg; 0.3 mmol) in EtOH (150 ml) is hydrogenated over Pd/C (10%; 250 mg) at 1 atm and room temp. for 1 h. After filtration and evaporation of the solvent, the residue is purified via chromatography (TBME/MeOH/NH3conc 95/5/0.5 to 90/10/2) to yield the title compound as colorless crystals (53 mg; 74 %). 1H-NMR (400MHz; DMSO-d6), No. (ppm) : 1.38 (s, 2.64 (bd, 3.03 (bd, 1H); 3.17 (bd, 1H) ; 3.71 (m, 4H) ; 3.92 (d, 1 H); 3.99 (d, 1 H); 6.67 (bs, 0.5H) ; 7.27 (bs, 0.5H). MS (m/z) ES+: 229.1 (MH+, 100).

References: [1]Patent: WO2005/103054,2005,A2 .Location in patent: Page/Page column 142.

3
[ 864448-41-9 ]
[ 1255206-70-2 ]
[ 1433485-13-2 ]

Yield	Reaction Conditions	Operation in experiment
	In ethanol; at 140℃; for 1h;Microwave irradiation;	Commercially available tert-Butyl 3-oxa-7,9-diazabicyclo[3.3.1]nonane-7-carboxylate (300 mg, 1.3 mmol) and 4-methyl-5-[(2i?)-oxiran-2-yl]-2-benzofuran-l(3H)-one(INTERMEDIATE 2) (380 mg, 2.0 mmol) were dissolved in ethanol (10 ml) and heated in a microwave reactor at 140 C for 1 hour. The reaction was concentrated and purified by MPLC on ISCO RediSep purification column and eluted with 50%- 100% ethyl acetate/hexane to provide tert-butyl 9- [(2i.)-2-hydroxy-2-(4-methyl- 1 -oxo- 1 ,3 -dihydro-2-benzofuran-5-yl)ethyl] -3 - oxa-7,9-diazabicyclo[3.3.1 ]nonane-7-carboxylate.LC-MS (IE, m/z): 419 [M + 1]+.

References: [1]Patent: WO2013/66714,2013,A1 .Location in patent: Page/Page column 49.

4
[ 864448-41-9 ]
[ 82911-69-1 ]
[ 1445804-24-9 ]

Yield	Reaction Conditions	Operation in experiment
93%	In tetrahydrofuran; at 20℃; for 2.5h;	A mixture of <strong>[864448-41-9]3-oxa-7,9-diaza-bicyclo[3.3.1]nonane-7-carboxylic acid tert-butyl ester</strong> (716 mg, 3.14 mmol, WuXy AppTech) and 9-fluorenylmethoxycarbonyl-N-hydroxysuccinimide (1058 mg, 3.14 mmol) was prepared in anhydrous THF (11 mL) and stirred at RT for 2.5 hours. The reaction mixture was concentrated under vacuum to give a yellow oil. After purification by flash chromatography (silica, heptane / EtOAc), the title compound was obtained as a white foam (1.36 g, 93%). 1H NMR (300 MHz, CDCI3) delta 7.77 (d, J = 7.5 Hz, 2H), 7.55 (d, J = 7.3 Hz, 2H), 7.45-7.37 (m, 2H), 7.36-7.28 (m, 2H), 4.65-4.57 (m, 2H), 4.35-3.49 (m, 9H), 3.17-2.78 (m, 2H), 1.46 (s, 9H). HPLC (max plot) 96.5%; Rt 5.07 min. UPLC/MS: (MS+) 451.4 M+H]+).

References: [1]Patent: WO2013/91773,2013,A1 .Location in patent: Page/Page column 82.

5
[ 864448-41-9 ]
[ 82911-69-1 ]
[ 1445804-25-0 ]

References: [1]Patent: WO2013/91773,2013,A1 .

6
[ 864448-41-9 ]
7-methanesulfonyl-3-oxa-7,9-diazabicyclo[3.3.1]nonane [ No CAS ]

References: [1]Patent: WO2014/184328,2014,A1 .

7
[ 864448-41-9 ]
[ 501-53-1 ]
9-benzyl 7-tert-butyl 3-oxa-7,9-diazabicyclo[3.3.1]nonane-7,9-dicarboxylate [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
80%		To a solution of <strong>[864448-41-9]tert-butyl 3-oxa-7,9-diazabicyclo[3.3.1]nonane-7-carboxylate</strong> (0.500 g, 2.2 mmol) in dichloromethane (5 ml) was added triethylamine (0.443 g, 4.4 mmol) at room temperature. The mixture was stirred at room temperature for a few mins, and then benzyl chloroformate (0.751 g, 4.4 mmol) was added to the reaction mixture. The resulting mixture was stirred at room temperature overnight. The mixture was partitioned between dichloromethane and water. The organic phase was dried, and concentrated. The residue was purified by silica gel chromatography to give 9-benzyl 7-tert-butyl 3-oxa-7,9-diazabicyclo[3.3.1]nonane-7,9- dicarboxylate 133b (0.637 g, 80.0%). MS: calc'd (MH+) 363, measured (MH+) 363.

References: [1]Patent: WO2014/184328,2014,A1 .Location in patent: Page/Page column 215; 216.

8
[ 864448-41-9 ]
[ 1578155-69-7 ]
9-[(R)-6-(2-chloro-4-fluorophenyl)-5-methoxycarbonyl-2-thiazol-2-yl-3,6-dihydropyrimidin-4-ylmethyl]-3-oxa-7,9-diazabicyclo[3.3.1]nonane-7-carboxylic acid tert-butyl ester [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
94%	With N-ethyl-N,N-diisopropylamine; In dichloromethane; at 20℃; for 16h;	To a mixture of <strong>[864448-41-9]3-oxa-7,9-diaza-bicyclo[3.3.1]nonane-7-carboxylic acid tert-butyl ester</strong> (171 mg, 0.75mmol) and DIPEA(0.45 mL, 2.5 mmol) in CH2C12 (10 mL) was added (R)-6- bromomethyl-4-(2-chloro-4-fluoro-phenyl)-2-thiazol-2-yl-l,4-dihydro-pyrimidine-5-carboxylic acid methyl ester(222 mg, 0.5 mmol). The mixture was stirred at room temperature for 16 hours The mixture was concentrated in vacuo. The residue was purified by flash column chromatography to afford 9-[(R)-6-(2-chloro-4-fluoro-phenyl)-5-methoxycarbonyl-2-thiazol-2- yl-3,6-dihydro-pyrimidin-4-ylmethyl]-<strong>[864448-41-9]3-oxa-7,9-diaza-bicyclo[3.3.1]nonane-7-carboxylic acid tert-butyl ester</strong> as yellow oil (0.28 g, 94%). MS: calc'd (MH+) 592, measured (MH+) 592.

References: [1]Patent: WO2014/184328,2014,A1 .Location in patent: Page/Page column 119.

9
[ 864448-41-9 ]
7-methanesulfonyl-3-oxa-7,9-diazabicyclo[3.3.1]nonane-9-carboxylic acid benzyl ester [ No CAS ]

References: [1]Patent: WO2014/184328,2014,A1 .

10
[ 864448-41-9 ]
7-methyl-3-oxa-7,9-diazabicyclo[3.3.1]nonane [ No CAS ]

References: [1]Patent: WO2014/184328,2014,A1 .

11
[ 864448-41-9 ]
7-isopropyl-3-oxa-7,9-diazabicyclo[3.3.1]nonane [ No CAS ]

References: [1]Patent: WO2014/184328,2014,A1 .

12
[ 864448-41-9 ]
7-(2,2-difluoroethyl)-3-oxa-7,9-diazabicyclo[3.3.1]nonane [ No CAS ]

References: [1]Patent: WO2014/184328,2014,A1 .

13
[ 864448-41-9 ]
(R)-6-(7-acetyl-3-oxa-7,9-diazabicyclo[3.3.1]non-9-ylmethyl)-4-(2-chloro-4-fluorophenyl)-2-thiazol-2-yl-1,4-dihydropyrimidine-5-carboxylic acid methyl ester [ No CAS ]

References: [1]Patent: WO2014/184328,2014,A1 .

14
[ 864448-41-9 ]
(R)-4-(2-chloro-4-fluorophenyl)-6-(3-oxa-7,9-diazabicyclo[3.3.1]non-9-ylmethyl)-2-thiazol-2-yl-1,4-dihydropyrimidine-5-carboxylic acid methyl ester [ No CAS ]

References: [1]Patent: WO2014/184328,2014,A1 .

15
[ 864448-41-9 ]
(R)-4-(2-chloro-4-fluorophenyl)-6-(7-methylsulfamoyl-3-oxa-7,9-diazabicyclo[3.3.1]non-9-ylmethyl)-2-thiazol-2-yl-1,4-dihydropyrimidine-5-carboxylic acid methyl ester [ No CAS ]

References: [1]Patent: WO2014/184328,2014,A1 .

16
[ 864448-41-9 ]
9-[(R)-6-(2-chloro-4-fluorophenyl)-5-methoxycarbonyl-2-thiazol-2-yl-3,6-dihydropyrimidin-4-ylmethyl]-3-oxa-7,9-diazabicyclo[3.3.1]nonane-7-carboxylic acid methyl ester [ No CAS ]

References: [1]Patent: WO2014/184328,2014,A1 .

17
[ 864448-41-9 ]
(R)-6-(7-carbamoyl-3-oxa-7,9-diazabicyclo[3.3.1]non-9-ylmethyl)-4-(2-chloro-4-fluorophenyl)-2-thiazol-2-yl-1,4-dihydropyrimidine-5-carboxylic acid methyl ester [ No CAS ]

References: [1]Patent: WO2014/184328,2014,A1 .

18
[ 864448-41-9 ]
C₂₇H₃₂ClFN₆O₇S₂ [ No CAS ]

References: [1]Patent: WO2014/184328,2014,A1 .

19
[ 864448-41-9 ]
(R)-4-(2-chloro-4-fluorophenyl)-6-(7-sulfamoyl-3-oxa-7,9-diazabicyclo[3.3.1]non-9-ylmethyl)-2-thiazol-2-yl-1,4-dihydropyrimidine-5-carboxylic acid methyl ester [ No CAS ]

References: [1]Patent: WO2014/184328,2014,A1 .

20
[ 864448-41-9 ]
7-(1-ethoxycarbonyl-1-methylethyl)-3-oxa-7,9-diazabicyclo[3.3.1]nonane-9-carboxylic acid benzyl ester [ No CAS ]

References: [1]Patent: WO2014/184328,2014,A1 .

21
[ 864448-41-9 ]
2-methyl-2-(3-oxa-7,9-diazabicyclo[3.3.1]non-7-yl)propionic acid ethyl ester [ No CAS ]

References: [1]Patent: WO2014/184328,2014,A1 .

22
[ 864448-41-9 ]
(R)-4-(2-chloro-4-fluorophenyl)-6-[7-(2-hydroxyacetyl)-3-oxa-7,9-diazabicyclo[3.3.1]non-9-ylmethyl]-2-thiazol-2-yl-1,4-dihydropyrimidine-5-carboxylic acid methyl ester [ No CAS ]

References: [1]Patent: WO2014/184328,2014,A1 .

23
[ 864448-41-9 ]
3-[(1S,5R)-9-[[(4R)-4-(2-chloro-4-fluoro-phenyl)-5-methoxycarbonyl-2-thiazol-2-yl-1,4-dihydropyrimidin-6-yl]methyl]-3-oxa-7,9-diazabicyclo[3.3.1]nonan-7-yl]-2,2-dimethyl-3-oxo-propanoic acid [ No CAS ]

References: [1]Patent: WO2014/184328,2014,A1 .

24
[ 864448-41-9 ]
methyl (4R)-4-(2-chloro-4-fluorophenyl)-6-[(6-oxo-3-oxa-7,9-diazabicyclo[3.3.1]nonan-9-yl)methyl]-2-thiazol-2-yl-1,4-dihydropyrimidine-5-carboxylate [ No CAS ]

References: [1]Patent: WO2014/184328,2014,A1 .

25
[ 864448-41-9 ]
tert-butyl 6-oxo-3-oxa-7,9-diazabicyclo[3.3.1]nonane-7-carboxylate [ No CAS ]

References: [1]Patent: WO2014/184328,2014,A1 .

26
[ 864448-41-9 ]
[ 501-53-1 ]
3-oxa-7,9-diazabicyclo[3.3.1]nonane-9-carboxylic acid benzyl ester [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
100%		W To a solution of <strong>[864448-41-9]3-oxa-7,9-diaza-bicyclo[3.3.1]nonane-7-carboxylic acid tert-butyl ester</strong> (WuXi AppTec (Wuhan) Co., Ltd, CAS: 864448-41-9) (173 mg, 0.76 mmol) in CH2C12 (20 mL) at 0 C was added DIPEA (195 mg, 1.52 mmol) and CbzCI (155 mg, 0.91 mmol). The reaction mixture was warmed up to room temperature and then stirred for 2 hours. The mixture was quenched with sat. NH4C1, and then extracted with EtOAc (60 mL). The organic layer was washed with sat. NH4C1, sat. NaHC03 and brine (20 mL) respectively, and then dried over Na2S04. The solvent was removed to give a white solid (250 mg, 78%), which was dissolved in CH2C12 (2 mL). To the solution was added HCI in dioxane (4 M, 2 mL). The reaction mixture was stirred at room temperature for 2 hours. The solvent was removed to give 3-oxa-7,9-diaza- bicyclo[3.3.1]nonane-9-carboxylic acid benzyl ester (Compound X) (205 mg, 100%) as a white solid. MS: calc'd (MH+) 263, measured (MH+) 263.

References: [1]Patent: WO2014/184328,2014,A1 .Location in patent: Page/Page column 114.

27
[ 864448-41-9 ]
[ 501-53-1 ]
O₉-benzyl O₇-tert-butyl 6-oxo-3-oxa-7,9-diazabicyclo[3.3.1]nonane-7,9-dicarboxylate [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
150 mg		To a solution <strong>[864448-41-9]tert-butyl 3-oxa-7,9-diazabicyclo[3.3.1]nonane-7-carboxylate</strong> (400mg, L75 mmol) and Et3N (0.49 niL, 3.5 mrnol) in DCM (10 mL) was added CbzCl (448 mg, 2.63 mmoi) at room temperature. The reaction mixture was stirred at room temperature for 2 hours and then water (10.0 mL) was added, and the mixture is extracted three times with EtOAc (30 rnL each). The combined organic phase was dried over Na2SO4 and concentrated. The residue was purifiedby silica gel colunm chromatography (PE: EtOAc, from 10:1 to 2: 1) to give a white solid (300 mg). The solid was dissolved in ACN (8 mL) and water (2 rnL), to which were added RuC13 (35 mg, 0.170 mmol) and Na104 (532 mg, 2.48 mmoi). The reaction mixture was stirred at room temperature for 36 hours and water (10 niL) was added, and the mixture was extracted three times with EtOAc (20 mL), The combined organic phase was dried over Na2SO4 andconcentrated. The residue was purified by column (PE: EtOAc, from 10:1 to 1: 1) to give the desired product 13a as a yellow oil (150 mg). LCMS (M-100+H) 277.1

References: [1]Patent: WO2014/184328,2014,A1 .
[2]Patent: WO2018/11162,2018,A1 .Location in patent: Page/Page column 38.

28
[ 864448-41-9 ]
(3-oxa-7,9-diazabicyclo[3.3.1]nonan-9-yl)(6-((2',4'-dimethyl-[4,5'-bithiazol]-2-yl)amino)pyridin-3-yl)methanone [ No CAS ]

References: [1]Bioorganic and Medicinal Chemistry,2017,vol. 25,p. 2177 - 2190.

29
[ 864448-41-9 ]
(6-((2',4'-dimethyl-[4,5'-bithiazol]-2-yl)amino)pyridin-3-yl)(7-(5-(trifluoromethyl)pyrimidin-2-yl)-3-oxa-7,9-diazabicyclo[3.3.1]nonan-9-yl)methanone [ No CAS ]

References: [1]Bioorganic and Medicinal Chemistry,2017,vol. 25,p. 2177 - 2190.

30
[ 864448-41-9 ]
6-((2',4'-dimethyl-[4,5'-bithiazol]-2-yl)amino)nicotinic acid [ No CAS ]
tert-butyl 9-(6-((2',4'-dimethyl-[4,5'-bithiazol]-2-yl)amino)nicotinoyl)-3-oxa-7,9-diazabicyclo[3.3.1]nonane-7-carboxylate [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
100%	With 1-[(1-(cyano-?2-?ethoxy-?2-?oxoethylidenaminooxy)?dimethylamino-?morpholino)]-uronium hexafluorophosphate; triethylamine; In N,N-dimethyl-formamide; at 20℃; for 1.5h;	General procedure: The mixture of 13a (151 mg, 0.423 mmol) and 4 N HCl in 1,4-dioxane solution (1.38 ml) was stirred at room temperature overnight. After concentration, the residue was crystalized with etherto afford the white precipitation. The resulting solid was collected by filtration to afford 14a (121 mg, 98.0%) as the white solid. MSESI (m/z) = 257 [M+H]+. To a solution of 4a (116 mg, 0.35 mmol)in DMF (2.3 ml) was added 14a (120 mg, 0.42 mmol), COMU (225 mg, 0.525 mmol) and Et3N (177 mg, 1.75 mmol) at room temperature.The reaction mixture was stirred at same temperature for 1.5 h. The reaction mixture was diluted with sat. NaHCO3 solution to afford the pale yellow precipitation. The resulting solid was collected by filtration to 16a

References: [1]Bioorganic and Medicinal Chemistry,2017,vol. 25,p. 2177 - 2190.

31
[ 864448-41-9 ]
tert-butyl (6S)-6-methyl-3-(6-oxo-3-oxa-7,9-diazabicyclo[3.3.1]nonan-7-yl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate [ No CAS ]

References: [1]Patent: WO2018/11162,2018,A1 .

32
[ 864448-41-9 ]
2-[7-[(6S)-5-tert-butoxycarbonyl-6-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-3-yl]-6-oxo-3-oxa-7,9-diazabicyclo[3.3.1]nonan-9-yl]acetic acid [ No CAS ]

References: [1]Patent: WO2018/11162,2018,A1 .

33
[ 864448-41-9 ]
benzyl 7-[(6S)-5-tert-butoxycarbonyl-6-methyl-6,7-dihydro-4H-pyrazolo[1,5,-a]pyrazin-3-yl]-6-oxo-3-oxa-7,9-diazabicyclo[3.3.1]nonane-9-carboxylate [ No CAS ]

References: [1]Patent: WO2018/11162,2018,A1 .

34
[ 864448-41-9 ]
tert-butyl (6S)-3-[9-(2-ethoxy-2-oxo-ethyl)-6-oxo-3-oxa-7,9-diazabicyclo[3.3.1]nonan-7-yl]-6-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate [ No CAS ]

References: [1]Patent: WO2018/11162,2018,A1 .

35
[ 864448-41-9 ]
2-[7-[(6S)-6-methyl-5-[(3,4,5-trifluorophenyl)carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-3-yl]-6-oxo-3-oxa-7,9-diazabicyclo[3.3.1]nonan-9-yl]acetic acid [ No CAS ]

References: [1]Patent: WO2018/11162,2018,A1 .

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• Acyl Group Substitution • Chan-Lam Coupling Reaction • Complex Metal Hydride Reductions • Halogenation • Heat of Combustion • Hydride Reductions • Lawesson's Reagent • Preparation of Amines • Reactions of Amines • Specialized Acylation Reagents-Carbodiimides and Related Reagents • Specialized Acylation Reagents-Ketenes

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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

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

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CAS No.: 864448-41-9

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CAS No.: 864448-41-9

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[ 864448-41-9 ] Synthesis Path-Downstream 1~35

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