[ CAS No. 1213314-31-8 ] {[proInfo.proName]}

Name: 1213314-31-8|(R)-2-(2-(Methylthio)phenyl)pyrrolidine|95%
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Product Details of [ 1213314-31-8 ]

CAS No. :	1213314-31-8	MDL No. :	MFCD08057894
Formula :	C₁₁H₁₅NS	Boiling Point :	-
Linear Structure Formula :	-	InChI Key :	XLTYHQGKUJLXRU-SNVBAGLBSA-N
M.W :	193.31	Pubchem ID :	7047909
Synonyms :

Safety of [ 1213314-31-8 ]

Signal Word:	Warning	Class:
Precautionary Statements:	P261-P280-P301+P312-P302+P352-P305+P351+P338	UN#:
Hazard Statements:	H302-H315-H319-H335	Packing Group:
GHS Pictogram:

Application In Synthesis of [ 1213314-31-8 ]

* 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.

Downstream synthetic route of [ 1213314-31-8 ]

[ 1213314-31-8 ] Synthesis Path-Downstream 1~23

1
[ 1884279-67-7 ]
[ 1213314-31-8 ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 4 steps 1: (3aR)-1-methyl-3,3-diphenyl-tetrahydro-pyrrolo[1,2-c][1,3,2]oxazaborole; dimethylsulfide borane complex / tetrahydrofuran; toluene / 3 h / 20 °C / Inert atmosphere 2: triethylamine / dichloromethane / 3 h / 0 - 20 °C / Inert atmosphere 3: trifluoroacetic acid / dichloromethane / 2 h / 20 °C / Inert atmosphere 4: sodium hydroxide / methanol / 20 °C / Inert atmosphere

2
[ 19614-16-5 ]
[ 1213314-31-8 ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 5 steps 1.1: magnesium; iodine / tetrahydrofuran / 2 h / 0 - 20 °C / Inert atmosphere; Reflux 1.2: 0.5 h / -78 - 0 °C / Inert atmosphere 2.1: (3aR)-1-methyl-3,3-diphenyl-tetrahydro-pyrrolo[1,2-c][1,3,2]oxazaborole; dimethylsulfide borane complex / tetrahydrofuran; toluene / 3 h / 20 °C / Inert atmosphere 3.1: triethylamine / dichloromethane / 3 h / 0 - 20 °C / Inert atmosphere 4.1: trifluoroacetic acid / dichloromethane / 2 h / 20 °C / Inert atmosphere 5.1: sodium hydroxide / methanol / 20 °C / Inert atmosphere

3
[ 1884279-69-9 ]
[ 1213314-31-8 ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 3 steps 1: triethylamine / dichloromethane / 3 h / 0 - 20 °C / Inert atmosphere 2: trifluoroacetic acid / dichloromethane / 2 h / 20 °C / Inert atmosphere 3: sodium hydroxide / methanol / 20 °C / Inert atmosphere

4
[ 1884279-72-4 ]
[ 1213314-31-8 ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 2 steps 1: trifluoroacetic acid / dichloromethane / 2 h / 20 °C / Inert atmosphere 2: sodium hydroxide / methanol / 20 °C / Inert atmosphere

5
[ 1213314-31-8 ]
[ 1884279-58-6 ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 3 steps 1: N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 20 °C / Inert atmosphere 2: dichloromethane / 1 h / Inert atmosphere 3: triethylamine / acetonitrile / 16 h / 20 °C / Inert atmosphere

6
[ 1213314-31-8 ]
[ 1884279-84-8 ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 2 steps 1: N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 20 °C / Inert atmosphere 2: dichloromethane / 1 h / Inert atmosphere

7
[ 1213314-31-8 ]
[ 1884279-64-4 ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 3 steps 1: N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 20 °C / Inert atmosphere 2: dichloromethane / 1 h / Inert atmosphere 3: triethylamine / acetonitrile / 16 h / 20 °C / Inert atmosphere

8
[ 1213314-31-8 ]
[ 1884279-88-2 ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 2 steps 1: N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 20 °C / Inert atmosphere 2: dichloromethane / 1 h / Inert atmosphere

9
[ 4530-20-5 ]
[ 1213314-31-8 ]
[ 1884279-75-7 ]

Yield	Reaction Conditions	Operation in experiment
98%	With N-ethyl-N,N-diisopropylamine; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate In N,N-dimethyl-formamide at 20℃; Inert atmosphere;
72%	Stage #1: BOC-glycine With 2-hydroxy-pyridine N-oxide; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; N-ethyl-N,N-diisopropylamine In N,N-dimethyl-formamide at 20℃; for 0.166667h; Inert atmosphere; Stage #2: (R)-(+)-2-(2-(methylthio)phenyl)pyrrolidine In N,N-dimethyl-formamide at 20℃; for 16h; Inert atmosphere;	1 Step 1: Formation of { 2- [(R)-2-(2-Methylsulfanyl-phenyl)-pyrrolidin- 1 -yll -2-oxo- ethyll-carbamic acid tert-butyl ester A solution of N-Boc-glycine (410 mg, 2.32 mmol), EDCI (498 mg, 2.55 mmol), HOPO (288 mg, 2.55 mmol) and DIPEA (0.58 mL, 3.48 mmol) in DMF (2 mL) was stirred at RT for 10 mm before the addition of a solution of (R)-2-(2-Methylsulfanyl-phenyl)-pyrrolidine (Akos Bioscience, 493 mg, 2.55 mmol) in DMF (2 mL). The resulting mixture was stirred at RT for 16h. It was then diluted with EtOAc and washed with aq. sat NH4C1. The aqueous phase was extracted again with EtOAc (2x). The combined organic phases were dried over Na2504, filtered and concentrated. Purification by flash chromatography on silica (Cyclohexane:EtOAc, gradient from 10:0 to 0:10) afforded the title compound as a colorless sticky oil that solidifies as a white solid upon cooling, (590 mg ,72%).’H NMR (CDC13) : rotamers. 7.37-6.87 (m, 5H), 5.55-5.20 (m, 2H), 4.02-3.18 (m, 4H), 2.52, 2.50 (2s, 3H), 2.43-1.77 (m, 4H), 1.43, 1.39 (2s, 9H).
72%	Stage #1: BOC-glycine With 2-hydroxy-pyridine N-oxide; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; N-ethyl-N,N-diisopropylamine In N,N-dimethyl-formamide at 20℃; for 0.166667h; Inert atmosphere; Stage #2: (R)-(+)-2-(2-(methylthio)phenyl)pyrrolidine In N,N-dimethyl-formamide at 20℃; for 16h; Inert atmosphere;	Step 1: Formation of{2-[(R)-2-(2-Methylsulfanyl-phenyl)-pyrrolidin-1-yl]-2-oxoethyl}-carbamic acidtert-butyl ester A solution of N-Boc-glycine (410 mg, 2.32 mmol), EDCI(498 mg, 2.55 mmol), HOPO (288 mg, 2.55 mmol) and DIPEA (0.58 mL, 3.48 mmol) inDMF (2 mL) was stirred at RT for 10 min before the addition of a solution of(R)-2-(2-Methylsulfanyl-phenyl)-pyrrolidine (Akos Bioscience, 493 mg, 2.55mmol) in DMF (2 mL). The resulting mixture was stirred at RT for 16h. It wasthen diluted with EtOAc and washed with aq. sat NH4Cl. The aqueousphase was extracted again with EtOAc (2x). The combined organic phases weredried over Na2SO4, filtered and concentrated. Purification by flashchromatography on silica (Cyclohexane: EtOAc, gradient from 10:0 to 0:10)afforded the title compound as a colorless sticky oil that solidifies as awhite solid upon cooling, (590 mg, 72%).1H NMR (CDCl3):rotamers. 7.37-6.87 (m, 5H), 5.55-5.20 (m, 2H), 4.02-3.18 (m, 4H), 2.52, 2.50(2s, 3H), 2.43-1.77 (m, 4H), 1.43, 1.39 (2s, 9H).

Reference： [1]Shore, Emma R.; Awais, Muhammad; Kershaw, Neil M.; Gibson, Robert R.; Pandalaneni, Sravan; Latawiec, Diane; Wen, Li; Javed, Muhammad A.; Criddle, David N.; Berry, Neil; O'Neill, Paul M.; Lian, Lu-Yun; Sutton, Robert [Journal of Medicinal Chemistry, 2016, vol. 59, # 6, p. 2596 - 2611]
[2]Current Patent Assignee: MERCK KGAA - WO2017/173048, 2017, A1 Location in patent: Paragraph 00134; 00162
[3]Grädler, Ulrich; Schwarz, Daniel; Blaesse, Michael; Leuthner, Birgitta; Johnson, Theresa L.; Bernard, Frederic; Jiang, Xuliang; Marx, Andreas; Gilardone, Marine; Lemoine, Hugues; Roche, Didier; Jorand-Lebrun, Catherine [Bioorganic and Medicinal Chemistry Letters, 2019, vol. 29, # 23]

10
[ 2488-15-5 ]
[ 1213314-31-8 ]
[ 1884279-76-8 ]

Yield	Reaction Conditions	Operation in experiment
44%	With N-ethyl-N,N-diisopropylamine; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate In N,N-dimethyl-formamide at 20℃; Inert atmosphere;

11
[ CAS Unavailable ]
[ 1213314-31-8 ]

Yield	Reaction Conditions	Operation in experiment
181 mg	With sodium hydroxide In methanol at 20℃; Inert atmosphere;

12
[ 1213314-31-8 ]
[ 1884279-83-7 ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 2 steps 1.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 2-hydroxy-pyridine N-oxide; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 0.17 h / 20 °C / Inert atmosphere 1.2: 16 h / 20 °C / Inert atmosphere 2.1: trifluoroacetic acid / dichloromethane / 20 °C / Inert atmosphere
	Multi-step reaction with 2 steps 1.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 2-hydroxy-pyridine N-oxide; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 0.17 h / 20 °C / Inert atmosphere 1.2: 16 h / 20 °C / Inert atmosphere 2.1: trifluoroacetic acid / dichloromethane / 20 °C / Inert atmosphere

Reference： [1]Current Patent Assignee: MERCK KGAA - WO2017/173048, 2017, A1
[2]Grädler, Ulrich; Schwarz, Daniel; Blaesse, Michael; Leuthner, Birgitta; Johnson, Theresa L.; Bernard, Frederic; Jiang, Xuliang; Marx, Andreas; Gilardone, Marine; Lemoine, Hugues; Roche, Didier; Jorand-Lebrun, Catherine [Bioorganic and Medicinal Chemistry Letters, 2019, vol. 29, # 23]

13
[ 1213314-31-8 ]
[ CAS Unavailable ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 3 steps 1.1: triethylamine; dmap / tetrahydrofuran / 3 h / 50 °C / Inert atmosphere 2.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 2-hydroxy-pyridine N-oxide; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 0.17 h / 20 °C / Inert atmosphere 2.2: 16 h / 20 °C / Inert atmosphere 3.1: tetrabutyl ammonium fluoride / tetrahydrofuran / 6 h / 20 °C / Inert atmosphere

Reference： [1]Current Patent Assignee: MERCK KGAA - WO2017/173048, 2017, A1

14
[ 1213314-31-8 ]
[ CAS Unavailable ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 2 steps 1.1: triethylamine; dmap / tetrahydrofuran / 3 h / 50 °C / Inert atmosphere 2.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 2-hydroxy-pyridine N-oxide; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 0.17 h / 20 °C / Inert atmosphere 2.2: 16 h / 20 °C / Inert atmosphere

Reference： [1]Current Patent Assignee: MERCK KGAA - WO2017/173048, 2017, A1

15
[ 1213314-31-8 ]
[ 2135585-37-2 ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 3 steps 1.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 2-hydroxy-pyridine N-oxide; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 0.17 h / 20 °C / Inert atmosphere 1.2: 16 h / 20 °C / Inert atmosphere 2.1: trifluoroacetic acid / dichloromethane / 20 °C / Inert atmosphere 3.1: dichloromethane / 2 h / 20 °C 3.2: 24 h / 50 °C

Reference： [1]Current Patent Assignee: MERCK KGAA - WO2017/173048, 2017, A1

16
[ 1213314-31-8 ]
[ 2135585-46-3 ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 3 steps 1.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 2-hydroxy-pyridine N-oxide; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 0.17 h / 20 °C / Inert atmosphere 1.2: 16 h / 20 °C / Inert atmosphere 2.1: trifluoroacetic acid / dichloromethane / 20 °C / Inert atmosphere 3.1: triethylamine; O‐(1H‐benzotriazol‐1‐yl)‐N,N,N′,N′‐tetramethyluronium tetrafluoroborate / tetrahydrofuran / 0.33 h / 20 °C / Inert atmosphere 3.2: 3 h / 20 °C / Inert atmosphere

Reference： [1]Current Patent Assignee: MERCK KGAA - WO2017/173048, 2017, A1

17
[ 108-30-5 ]
[ 1213314-31-8 ]
[ 2135585-94-1 ]

Yield	Reaction Conditions	Operation in experiment
100%	With dmap; triethylamine In tetrahydrofuran at 50℃; for 3h; Inert atmosphere;	Intermediate 17: 4-[(R)-2-(2-Methylsulfanyl-phenyl)-pyrrolidin-1-yl]-4-oxo-butyric acid A solution of (R)-2-(2-(methylthio)phenyl)pyrrolidine (Akos Bioscience, 200 mg, 1.03 mmol), succinic anhydride (145 mg, 1.45 mmol) and DMAP (0.05 g, 0.4 mmol) in THF (2.5 mL) and TEA (2.5 mL) was heated at 50°C for 3h. The reaction mixture was then diluted with 1M aq. HC1 (20 mL, pHi) and extracted with EtOAc (4 x 20 mL). The organic phase was dried over Na2SO4, filtered and concentrated to give the title compound as a brown oil (357 mg, 100%) which was used without further purification. 1H NMR (DMSO-d6) : rotamers. 12.0 (s, 1H), 7.48-6.88 (m, 4H), 5.24, 5.20 (2dd, 1H, 1=8.3 Hz, 1=1.7 Hz), 3.88-3.43 (m, 2H), 2.68-2.50 (m, 3H), 2.49- 2.11 (m, 5H), 1.95-1.58 (m, 3H).

Reference： [1]Current Patent Assignee: MERCK KGAA - WO2017/173048, 2017, A1 Location in patent: Paragraph 00134; 00166

18
[ 1213314-31-8 ]
[ 2135586-11-5 ]
[ 2135585-56-5 ]

Yield	Reaction Conditions	Operation in experiment
45%	With 2,4,6-tripropyl-1,3,5,2,4,6-trioxatriphosphinane-2,4,6-trioxide; triethylamine In dichloromethane at 20℃; for 12h;	21.3 Step 3: Formation of 1-f 2-F(R)-2-(2-Methylsulfanyl-phenyl)-pyrrolidin- l-yll -2-oxo- ethyl 1-3-Fl -(2-oxo-2,3 ,4,5-tetrahydro- 1 H-benzo Fbi azepin-7-yl)-ethyll -urea A solution of { 3- [1 -(2-Oxo-2,3 ,4,5-tetrahydro- 1 H-benzo [bj azepin-7-yl)-ethylj -ureido }-acetic acid (60 mg; 0.18 mmol; 100 mol%), (R)-2-(2-Methylsulfanyl-phenyl)-pyrrolidine (43 mg; 0.22 mmol; 120 mol%), TEA (0.08 ml; 0.55 mmol; 300 mol%) and 2,4,6-Tripropyl- [l,3,5,2,4,6jtrioxatriphosphinane 2,4,6-trioxide (88 mg; 0.27 mmol) in DCM (20 mL) was stirred at RT for 12 h. The reaction mixture was then diluted with dichloromethane (1 x 20 mL), washed with water (1 x 20 mL), brine (lx 2OmL), dried over anhydrous sodium sulphate, filtered and concentrated. Purification by flash chromatography on silica (DCM:MeOH, 98:2) afforded the title compound as a white solid (40 mg; 45 %). ‘H NMR (400 MHz, DMSO-d6) 9.45 (s, 1H), 7.26 (d, I = 8.0 Hz, 2H), 7.13-7.04 (m, 4H), 6.99-6.85 (m, 1H), 6.69 (s, 1H), 5.89 (d, I = 7.3 Hz, 1H), 5.20 (s, 1H), 7.72-7.49 (m, 1H), 3.95-3.78 (m, 3H), 3.53-3.51 (m, 1H), 3.11-3.06 (m, 1H), 2.66-2.62 (m, 3H), 2.07 (t, I = 7.08 Hz, 5H), 1.70 (s, 3H), 1.28-1.22 (m, 3H).

Reference： [1]Current Patent Assignee: MERCK KGAA - WO2017/173048, 2017, A1 Location in patent: Paragraph 00134; 00201

19
[ 1213314-31-8 ]
[ CAS Unavailable ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 3 steps 1.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 2-hydroxy-pyridine N-oxide; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 0.17 h / 20 °C / Inert atmosphere 1.2: 16 h / 20 °C / Inert atmosphere 2.1: trifluoroacetic acid / dichloromethane / 20 °C / Inert atmosphere 3.1: dichloromethane / 1 h / 20 °C / Inert atmosphere 3.2: 16 h / 60 °C / Inert atmosphere

Reference： [1]Grädler, Ulrich; Schwarz, Daniel; Blaesse, Michael; Leuthner, Birgitta; Johnson, Theresa L.; Bernard, Frederic; Jiang, Xuliang; Marx, Andreas; Gilardone, Marine; Lemoine, Hugues; Roche, Didier; Jorand-Lebrun, Catherine [Bioorganic and Medicinal Chemistry Letters, 2019, vol. 29, # 23]

20
[ 1213314-31-8 ]
[ CAS Unavailable ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 4 steps 1.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 2-hydroxy-pyridine N-oxide; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 0.17 h / 20 °C / Inert atmosphere 1.2: 16 h / 20 °C / Inert atmosphere 2.1: trifluoroacetic acid / dichloromethane / 20 °C / Inert atmosphere 3.1: dichloromethane / 1 h / 20 °C / Inert atmosphere 3.2: 16 h / 60 °C / Inert atmosphere 4.1: pyridine hydrogenfluoride / tetrahydrofuran / 5 h / 20 °C / Inert atmosphere

21
[ 19614-16-5 ]
[ 1213314-31-8 ]
[ 1213556-30-9 ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 3 steps 1.1: n-butyllithium / tetrahydrofuran; hexane / 1 h / -78 °C 1.2: 16 h / -78 - 20 °C 2.1: trifluoroacetic acid / neat liquid / 16 h 3.1: 4,4,5,5-tetramethyl-[1,3,2]-dioxaboralane; C₂₆H₂₄N₂P⁽¹⁺⁾*CF₃O₃S^(1-) / tetrahydrofuran / 16 h / -35 °C / Inert atmosphere; Glovebox

Reference： [1]Lundrigan, Travis; Welsh, Erin N.; Hynes, Toren; Tien, Chieh-Hung; Adams, Matt R.; Roy, Kayelani R.; Robertson, Katherine N.; Speed, Alexander W. H. [Journal of the American Chemical Society, 2019, vol. 141, # 36, p. 14083 - 14088]

22
[ 1884279-67-7 ]
[ 1213314-31-8 ]
[ 1213556-30-9 ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 2 steps 1: trifluoroacetic acid / neat liquid / 16 h 2: 4,4,5,5-tetramethyl-[1,3,2]-dioxaboralane; C₂₆H₂₄N₂P⁽¹⁺⁾*CF₃O₃S^(1-) / tetrahydrofuran / 16 h / -35 °C / Inert atmosphere; Glovebox

23
[ 2377935-77-6 ]
[ 1213314-31-8 ]
[ 1213556-30-9 ]

Yield	Reaction Conditions	Operation in experiment
84 % ee	With C₂₆H₂₄N₂P⁽¹⁺⁾*CF₃O₃S^(1-); 4,4,5,5-tetramethyl-[1,3,2]-dioxaboralane In tetrahydrofuran at -35℃; for 16h; Inert atmosphere; Glovebox; Overall yield = 88 percent; Overall yield = 89 mg; enantioselective reaction;

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Technical Information

• Dithioacetal Formation • Hydride Reductions • Nucleophilicity of Sulfur Compounds • Oxidation States of Sulfur Compounds • Reduction of Disulfides to Thiols • Thioacetals May Be Hydrolyzed to Carbonyl Compounds

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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

Purity	Size	Price	VIP Price	USA Stock *0-1 Day	Global Stock *5-7 Days	Quantity
{[ item.p_purity ]}	{[ item.pr_size ]}	Inquiry	{[ getRatePrice(item.pr_usd, 1,1,item.pr_is_large_size_no_price) ]} {[ getRatePrice(item.pr_usd,item.pr_rate,item.mem_rate,item.pr_is_large_size_no_price) ]}	{[ getRatePrice(item.pr_usd, 1,1,item.pr_is_large_size_no_price) ]}	Inquiry {[ getRatePrice(item.pr_usd,item.pr_rate,item.mem_rate,item.pr_is_large_size_no_price) ]} {[ getRatePrice(item.pr_usd,1,item.mem_rate,item.pr_is_large_size_no_price) ]}	{[ item.pr_usastock ]}		{[ item.pr_chinastock ]}	{[ item.pr_remark ]}

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. 1213314-31-8 ] {[proInfo.proName]}

Quality Control of [ 1213314-31-8 ]

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Product Details of [ 1213314-31-8 ]

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Application In Synthesis of [ 1213314-31-8 ]

[ 1213314-31-8 ] Synthesis Path-Downstream 1~23

Technical Information

Related Functional Groups of [ 1213314-31-8 ]

Sulfides

Precautionary Statements-General

Prevention

Response

Storage

Disposal

Physical hazards

Health hazards

Environmental hazards

Inquiry

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[ 1213314-31-8 ]