16732-86-8 (胆甾-4-烯,Cholest-4-ene)

快速询单

结构式：

胆甾-4-烯MOL文件

CAS号：

16732-86-8

中文名称：

胆甾-4-烯

英文名称：

Cholest-4-ene

分子式：

C₂₇H₄₆

分子量：

370.654148578644

胆甾-4-烯(16732-86-8)名称与标识符

名称

英文别名：

Cholest-4-ene;4-cholestene;Cholest-4-en;Cholest-4-ene100µg;cholest-5-ene;Coprostene;(8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene;NS00052336;YWHWYTRNKBGSRE-HKQCOZBKSA-N;16732-86-8;(8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-((R)-6-methylheptan-2-yl)-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene;

标识符

InChIKey：

YWHWYTRNKBGSRE-HKQCOZBKSA-N

Inchi：

1S/C27H46/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h11,19-20,22-25H,6-10,12-18H2,1-5H3/t20-,22+,23-,24+,25+,26+,27-/m1/s1

SMILES：

[C@]12(C)CC[C@@H]3[C@@]4(C)CCCC=C4CC[C@H]3[C@@H]1CC[C@@H]2[C@H](C)CCCC(C)C

胆甾-4-烯(16732-86-8)物化性质

实验特性

LogP : 8.41790
PSA : 0.00000
折射率 : 1.514
沸点 : 447.862°C at 760 mmHg
闪点 : 220.908°C
密度 : 0.942

计算特性

精确分子量 : 370.36000
氢键供体数量 : 0
氢键受体数量 : 0
可旋转化学键数量 : 5
同位素质量 : 370.36
重原子数量 : 27
复杂度 : 556
同位素原子数量 : 0
确定原子立构中心数量 : 0
不确定原子立构中心数量 : 7
确定化学键立构中心数量 : 0
不确定化学键立构中心数量 : 0
共价键单元数量 : 1
疏水参数计算参考值（XlogP） : 10.1
拓扑分子极性表面积 : 0Å²

胆甾-4-烯(16732-86-8)推荐厂家更多厂家(1)

公司名称	手机号/电话	联系人	QQ	微信	询单
金锦乐（湖南）化学有限公司		金锦乐	1226360695		询单

胆甾-4-烯(16732-86-8)相关文献

1. Hydroxylation of Δ4-steroids by osmium tetraoxide; stereochemistry and substituent effects
James R. Bull,Jan Floor J. Chem. Soc. Perkin Trans. 1 1977 724
2. Steroids and walden inversion. Part XXVI. 4β-Methoxycholest-5-ene, 6β-methoxycholest-4-ene, and related compounds
D. N. Jones,J. R. Lewis,C. W. Shoppee,G. H. R. Summers J. Chem. Soc. 1955 2876
3. Steroidal sulphur compounds. Part IX. 6α- and 6β-Methylsulphinylcholest-4-ene and related compounds; stereochemical aspects of the allyl sulphoxide–sulphenate rearrangement
D. Neville Jones,John Blenkinsopp,Anthony C. F. Edmonds,Essam Helmy,Richard J. K. Taylor J. Chem. Soc. Perkin Trans. 1 1973 2602
4. 344. The reactions of hydrazones and related compounds with strong bases. Part I. A modified Wolff–Kishner procedure
M. F. Grundon,H. B. Henbest,M. D. Scott J. Chem. Soc. 1963 1855
5. Hofmann degradation of 5α-cholestan-4α- and 5α-cholestan-4β-yltrimethylammonium salts
E. N. Wall,J. McKenna J. Chem. Soc. B 1970 318
6. Steric mechanism of formation of the PdCl π-allyl derivative from [6β-2H]cholest-4-ene
Ian J. Harvie,Francis J. McQuillin J. Chem. Soc. Chem. Commun. 1978 747
7. Steroids and related studies. Part XIX. Products of the Schmidt reaction with cholest-4-ene-3,6-dione
Harkishan Singh,S. Padmanabhan,Ajay K. Bose,Irene Kugajevsky J. Chem. Soc. Perkin Trans. 1 1972 993
8. Steroids and Walden inversion. Part LXIII. Substitution reactions of the 5α-cholestan-4-ols: a further example of Walden retention
C. W. Shoppee,R. E. Lack,S. C. Sharma J. Chem. Soc. C 1968 2083
9. p-TsOH-Catalyzed one-pot transformation of di- and trihydroxy steroids towards diverse A/B-ring oxo-functionalization
Antara Sarkar,Jayanta Das,Pranab Ghosh New J. Chem. 2017 41 9051
10. Applications of chromium(II) chloride. Part III. Chromium(II) chloride reduction of some enediones
J. R. Hanson,E. Premuzic J. Chem. Soc. C 1969 1201