顺-4-[[2-(2,4-二氯苯基)-2-(1H-咪唑-1-基甲基)-1,3-二噁戊环-4-基]甲硫基]苯胺二盐酸

顺-4-[[2-(2,4-二氯苯基)-2-(1H-咪唑-1-基甲基)-1,3-二噁戊环-4-基]甲硫基]苯胺二盐酸 基本信息
CAS号 84371-64-2 分子式 C31H41NO4
分子量 491.66200 精确质量 　491.30400
PSA 　62.16000 LogP 　4.77530
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目录
基本信息 物化性质

基本信息 展开↓

CAS号：
84371-64-2
分子式：
C31H41NO4
分子量：
491.66200
中文名称：
顺-4-[[2-(2,4-二氯苯基)-2-(1H-咪唑-1-基甲基)-1,3-二噁戊环-4-基]甲硫基]苯胺二盐酸
英文名称：
(5R,11R,13S,14S,17S)-11-[4-(Dimethylamino)phenyl]-13-methyl-17-(1 -propyn-1-yl)-1,2,6,7,8,11,12,13,14,15,16,17-dodecahydrospiro[cyc lopenta[a]phenanthrene-3,2'-[1,3]dioxolane]-5,17(4H)-diol
中文别名：
顺-4-[[2-(2,4-二氯苯基)-2-(1H-咪唑-1-基甲基)-1,3-二噁戊环-4-基]甲硫基]苯胺二盐酸;
米非司酮中间体;
(R)-4-Cloro-3-Hydroxybutyronitrile;
(R)-4-Chloro-3-hydroxybutyronitrile;
(2R)-1-chloropent-4-yn-2-ol;
(R)-(+)-4-chloro 3-hydroxybutyronitrile;
N-Boc-4-methylene-L-proline;
3-(3',5'-Difluorophenyl)propanoic acid;
L-2-aminodecanoic acid;
Willow leaf extract;
Beli stem bark extract;
Cortex Salicis;
Salix alba Linn., stem bark extract;
Willow, Salix alba, ext.;
2-BUTYL-4-CHLORO-IMIDAZOLE-5-CARBALDEHYDE;
2-Butyl-4-Chloro-5-Imidazolecarboxaldehyde;
2-Butyl-4-Chloro-5-Imidazole Carboxaldehyde;
2-Butyl-5-chloro-1H-imidazole-4-Carboxaldehyde;
(R)-1-Boc-3-Pyrrolidinol;
(R)-1-Boc-3-Hydroxypyrrolidine;
1-N-Boc-3-Hydroxy-Pyrrolidine;
1-Boc-(R)-3-Hydroxypyrrolidine;
KBio3_001866;
KBioGR_001616;
N-(3-((4-Amino-6,7-dimethoxy-2-q;
Alfuzosine Hydrochloride
英文别名：
(5R,11R,13S,14S,17S)-11-[4-(Dimethylamino)phenyl]-13-methyl-17-(1 -propyn-1-yl)-1,2,6,7,8,11,12,13,14,15,16,17-dodecahydrospiro[cyc lopenta[a]phenanthrene-3,2'-[1,3]dioxolane]-5,17(4H)-diol;
11β-[(4-N,N-dimethylamino)phenyl)]-17α-(propyn-1-ynyl)-3,3-ethylendioxy-estra-9-en-5α,17β-diol;
Estr-9-En-3-One, 11-[4-(Dimethylamino)Phenyl]-5,17-Dihydroxy-17-(1-Propynyl)-, Cyclic 1,2-Ethanediyl Acetal, (5A,11B,17B)-;
Mifepristone Precursor;
Estr-9-en-3-one, 11-[4-(dimethylamino)phenyl]-5,17-dihydroxy-17-(1-propynyl)-cyclic 1,2-ethanediyl acetal,(5a,11b,17b)-;
(R)-(+)-4-chloro 3-hydroxybutyronitrile;
N-Boc-4-methylene-L-proline;
3-(3',5'-Difluorophenyl)propanoic acid;
L-2-aminodecanoic acid;
Willow leaf extract;
Beli stem bark extract;
Cortex Salicis;
Salix alba Linn., stem bark extract;
Willow, Salix alba, ext.;
2-BUTYL-4-CHLORO-IMIDAZOLE-5-CARBALDEHYDE;
2-Butyl-4-Chloro-5-Imidazolecarboxaldehyde;
2-Butyl-4-Chloro-5-Imidazole Carboxaldehyde;
2-Butyl-5-chloro-1H-imidazole-4-Carboxaldehyde;
(R)-1-Boc-3-Pyrrolidinol;
(R)-1-Boc-3-Hydroxypyrrolidine;
1-N-Boc-3-Hydroxy-Pyrrolidine;
1-Boc-(R)-3-Hydroxypyrrolidine;
KBio3_001866;
KBioGR_001616;
N-(3-((4-Amino-6,7-dimethoxy-2-q;
Alfuzosine Hydrochloride
精确分子量/精确质量：
491.30400
极性分子表面积/PSA：
62.16000
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：
InChI=1/C31H41NO4/c1-5-13-30(34)15-11-25-23-10-14-29(33)20-31(35-17-18-36-31)16-12-26(29)27(23)24(19-28(25,30)2)21-6-8-22(9-7-21)32(3)4/h6-9,23-25,33-34H,10-12,14-20H2,1-4H3/t23?,24-,25+,28+,29-,30+/m1/s1

物化性质展开↓

密度：
1.243 g/cm3
沸点：
664.475ºC at 760 mmHg
闪点：
355.662ºC
折射率：
1.627
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