苄基青霉素氯咪唑
[CAS# 6011-39-8]

基本信息

• 产品名称: 苄基青霉素氯咪唑
• 英文名: Benzylpenicillinclemizole
• 别名: 1-[(4-Chlorophenyl)Methyl]-2-(1-Pyrrolidinylmethyl)Benzimidazole; (2S,5R,6R)-3,3-Dimethyl-7-Oxo-6-[(1-Oxo-2-Phenylethyl)Amino]-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylic Acid; 1-(4-Chlorobenzyl)-2-(Pyrrolidin-1-Ylmethyl)Benzimidazole; (2S,5R,6R)-7-Keto-3,3-Dimethyl-6-[(2-Phenylacetyl)Amino]-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylic Acid; 1-[(4-Chlorophenyl)Methyl]-2-(Pyrrolidin-1-Ylmethyl)Benzimidazole; (2S,5R,6R)-3,3-Dimethyl-7-Oxo-6-(2-Phenylethanoylamino)-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylic Acid
• 分子式: C₃₅H₃₈ClN₅O₄S
• 分子量: 660.23
• CAS 登录号: 6011-39-8
• 分子行输入简码 SMILES: [C@H]12SC([C@@H](N1C(=O)[C@H]2NC(=O)CC3=CC=CC=C3)C(=O)O)(C)C.C4=CC=CC5=C4[N](C(=N5)CN6CCCC6)CC7=CC=C(Cl)C=C7
• 国际化学标识码 InChI: 1S/C19H20ClN3.C16H18N2O4S/c20-16-9-7-15(8-10-16)13-23-18-6-2-1-5-17(18)21-19(23)14-22-11-3-4-12-22;1-16(2)12(15(21)22)18-13(20)11(14(18)23-16)17-10(19)8-9-6-4-3-5-7-9/h1-2,5-10H,3-4,11-14H2;3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22)/t;11-,12+,14-/m.1/s1
• 国际化学标识检索码 InChIKey: GKPMEGXMKPQRTN-CBDIPHIASA-N

物理化学性质

• 沸点: 506.1°C at 760 mmHg （计算值）
• 闪点: 259.9°C （计算值）