2-苄硫基烟酸

CAS号
112811-90-2
CCD编号
CCD00147441
分子式
C13 H11 N O2 S
分子量
245.301

基本信息

产品名称: 2-苄硫基烟酸
CAS: 112811-90-2
中文同义词: 2-苄硫基烟酸
英文同义词: 2-PHENYLMETHYLTHIONICOTINIC ACID ; 2-THIOBENZYL NICOTINIC ACID ; 2-(BENZYLTHIO)NICOTINIC ACID ; 2-THIOBENZYPYRIDINE-3-CARBOXYLIC ACID ; 2-BENZYLSULFANYL-NICOTINIC ACID ; 2-(PHENYLMETHYLTHIO)PYRIDINE-3-CARBOXYLIC ACID ; 2-[(PHENYLMETHYL)THIO]-3-PYRIDINECARBOXYLIC ACID ; 2-(BENZYLSULFANYL)PYRIDINE-3-CARBOXYLIC ACID
MDL号: MFCD00661380
氢键受体数量: 3
氢键供体数量: 1
Smile: c1ccc(cc1)CSc2c(cccn2)C(=O)O
InChi: InChI=1S/C13H11NO2S/c15-13(16)11-7-4-8-14-12(11)17-9-10-5-2-1-3-6-10/h1-8H,9H2,(H,15,16)
InChiKey: InChIKey=OJNZDGDYAXCHPB-UHFFFAOYSA-N

性质

沸点: MP: 187.0-190.0 DEG C

安全信息

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