1320-44-1
中文名称
甲基苄索氯铵
英文名称
OCTYLCRESOXYETHOXYETHYL DIMETHYL-BENZYL AMMONIUM CHLORIDE
CAS
1320-44-1
分子式
C28H44NO2.Cl
MOL 文件
1320-44-1.mol
1320-44-1 结构式
基本信息
中文别名
甲基苄索氯铵 英文别名
Methylbenzethonium ChliorideDIISOBUTYLCRESOXYETHYLDIMETHYLBENZYLAMMONIUMCHLORIDE
Octylcreoxyethoxyethyl dimethyl-benzyl ammonium chloide
benzyl-dimethyl-[2-[2-[3-methyl-4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethyl]ammonium chloride
benzyl-dimethyl-[2-[2-[3-methyl-4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethyl]azanium chloride
dimethyl-[2-[2-[3-methyl-4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethyl]-(phenylmethyl)azanium chloride
物理化学性质
熔点161-163°
主要应用pharmaceutical (small molecule)
InChI1S/C28H44NO2.ClH/c1-23-20-25(14-15-26(23)28(5,6)22-27(2,3)4)31-19-18-30-17-16-29(7,8)21-24-12-10-9-11-13-24;/h9-15,20H,16-19,21-22H2,1-8H3;1H/q+1;/p-1
InChIKeyWYWSKWZUWZLELX-UHFFFAOYSA-M
SMILES[Cl-].[N+](CCOCCOc2cc(c(cc2)C(CC(C)(C)C)(C)C)C)(Cc1ccccc1)(C)C