methyl 2-[2-[(10R,11S,13S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl]sulfanylacetate

methyl 2-[2-[(10R,11S,13S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl]sulfanylacetate 基本信息
CAS号 114967-89-4 分子式 C24H34O6S
分子量 450.58800 精确质量  450.20800
PSA  126.20000 LogP  2.69550

基本信息 展开↓

CAS号:
114967-89-4
3D弹球模型:
立即前往扯扯看
分子式:
C24H34O6S
分子量:
450.58800
英文名称:
methyl 2-[2-[(10R,11S,13S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl]sulfanylacetate
英文别名:
methyl 2-[2-[(10R,11S,13S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl]sulfanylacetate;
Acetic acid, [[(11b)-11,17-dihydroxy-3,20-dioxopregn-4-en-21-yl]thio]-,methyl ester (9CI)
精确分子量/精确质量:
450.20800
极性分子表面积/PSA:
126.20000
油水分配系数/LogP:

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值,反映了物质在油水两相中的分配情况。其中、LogP值越大,说明该物质越亲油;反之,LogP值越小,则说明该物质越亲水。
InChI:
The Key: HHXLBWRVDHEWKT-RPPPWEFESA-N

物化性质展开↓

密度:
1.29g/cm3
沸点:
610.3ºC at 760mmHg
闪点:
322.9ºC
折射率:
1.589
蒸汽压:
1.92E-17mmHg at 25°C

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    methyl 2-[2-[(10R,11S,13S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl]sulfinylacetate

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