methyl (4R)-4-[(3R,12S)-3-acetyloxy-12-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate

methyl (4R)-4-[(3R,12S)-3-acetyloxy-12-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate 基本信息
CAS号 27240-83-1 分子式 C27H44O5
分子量 448.63500 精确质量  448.31900
PSA  72.83000 LogP  5.13710

等价的CAS号:

27240-83-1,99598-25-1,99598-27-3

基本信息 展开↓

CAS号:
27240-83-1
3D弹球模型:
立即前往扯扯看
分子式:
C27H44O5
分子量:
448.63500
英文名称:
methyl (4R)-4-[(3R,12S)-3-acetyloxy-12-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate
英文别名:
methyl (4R)-4-[(3R,12S)-3-acetyloxy-12-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate;
3-acetyl methyldeoxycholate;
Methyl 3alpha-acetoxy-12alpha-hydroxycholanate;
5beta-Cholanic acid-3alpha,12alpha-diol 3-acetate methyl ester;
3|A,12|A-Dihydroxy-5|A-cholan-24-oic acid methyl ester;
methyl deoxycholate-3'-acetate;
5|A-Cholanic acid-3|A,12|A-diol 3-acetate methyl ester;
3alpha,12alpha-Dihydroxy-5beta-cholan-24-oic acid methyl ester;
Methyl 3|A-acetoxy-12|A-hydroxycholanate
精确分子量/精确质量:
448.31900
极性分子表面积/PSA:
72.83000
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: FVYCOKNQUSFTBH-RFTNVYQZSA-N

物化性质展开↓

密度:
1.1g/cm3
沸点:
518.9ºC at 760 mmHg
闪点:
161ºC
折射率:
1.525
蒸汽压:
6.19E-13mmHg at 25°C

安全信息展开↓

WGK_Germany:
3
德国有关水污染物质的分类清单

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