cas号： 100858-21-7 ，名称： (4S,7aR)-1-[(2S)-6-(Methoxymethoxy)-6-methyl-3-oxo-4-heptyn-2-yl] -7a-methyloctahydro-1H-inden-4-yl benzoate 的性质/作用/用途-化学加百科

(4S,7aR)-1-[(2S)-6-(Methoxymethoxy)-6-methyl-3-oxo-4-heptyn-2-yl] -7a-methyloctahydro-1H-inden-4-yl benzoate

(4S,7aR)-1-[(2S)-6-(Methoxymethoxy)-6-methyl-3-oxo-4-heptyn-2-yl] -7a-methyloctahydro-1H-inden-4-yl benzoate 基本信息
CAS号	100858-21-7	分子式	C27H36O5
分子量	440.57200	精确质量	440.25600
PSA	61.83000	LogP	5.03610

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CAS号：: 100858-21-7
3D弹球模型：: 立即前往扯扯看
分子式：: C27H36O5
分子量：: 440.57200
英文名称：: (4S,7aR)-1-[(2S)-6-(Methoxymethoxy)-6-methyl-3-oxo-4-heptyn-2-yl] -7a-methyloctahydro-1H-inden-4-yl benzoate
英文别名：: (4S,7aR)-1-[(2S)-6-(Methoxymethoxy)-6-methyl-3-oxo-4-heptyn-2-yl] -7a-methyloctahydro-1H-inden-4-yl benzoate;
(7aR)-1-((S)-1-iodopropane-2-yl)-7a-methyloctahydro-1H-inden-4-ol;
(1R,3aR,4S,7aR)-Octahydro-1-[(1S)-2-iodo-1-methylethyl]-7a-methyl-1H-inden-4-ol;
(1R,3aR,4S,7aR)-octahydro-1-[(S)-1-iodopropan-2-yl]-7a-methyl-1H-inden-4-ol;
(8S,20S)-des-A,B-20-(iodomethyl)pregnan-8-ol;
De-A,B-22-iodo-23,24-dinorcholestan-8-ol;
[1R-[1|A(S*),3a|A,4|A,7a|A]]-Octahydro-1-(2-iodo-1-methylethyl)-7a-methyl-1H-inden-4-ol
精确分子量/精确质量：: 440.25600
极性分子表面积/PSA：: 61.83000
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: KHCJJTDZYYBWIM-XJCUKNONSA-N

100858-20-6

(22R)-des-A,B-8β-(benzoyloxy)-25-[(methoxymethyl)oxy]cholest-23-yn-22-ol
→

~93%
100858-21-7

(4S,7aR)-1-[(2S)-6-(Methoxymethoxy)-6-methyl-3-oxo-4-heptyn-2-yl] -7a-methyloctahydro-1H-inden-4-yl benzoate

100858-20-6

(22R)-des-A,B-8β-(benzoyloxy)-25-[(methoxymethyl)oxy]cholest-23-yn-22-ol