(5α,10α)-5,10-Epoxy-estr-9(11)-ene-3,17-dione Cyclic 3-(1,2-Ethanediyl Acetal) 基本信息
| 中文名称 | (5α,10α)-5,10-Epoxy-estr-9(11)-ene-3,17-dione Cyclic 3-(1,2-Ethanediyl Acetal) |
|---|---|
| 中文同义词 | (5ALPHA,10ALPHA)-5,10-环氧-雌甾-9(11)-烯-3,17-二酮环3-(1,2-乙二基缩醛) |
| 英文名称 | (5α,10α)-5,10-Epoxy-estr-9(11)-ene-3,17-dione Cyclic 3-(1,2-Ethanediyl Acetal) |
| 英文同义词 | (5α,10α)-5,10-Epoxy-estr-9(11)-ene-3,17-dione Cyclic 3-(1,2-Ethanediyl Acetal);BAMMJXIMVWLRCU-YAUBAPCASA-N;(5a,10b)-5,10-Epoxy-estr-9(11)-ene-3,17-dione Cyclic 3-(1,2-Ethanediyl Acetal);Estr-9(11)-ene-3,17-dione, 5,10-epoxy-, cyclic 3-(1,2-ethanediyl acetal), (5α,10α)-;13'-methyl-1',2',6',7',8',12',13',14',15',16'-decahydro-4'H,17'H-spiro[[1,3]dioxolane-2,3'-[5,10]epoxycyclopenta[a]phenanthren]-17'-one;(5′R,8′S,10′R,13′S,14′S)-13′-methyl-1′,2′,6′,7′8′,12′,13′,14′,15′,16′-decahydro-17′H-spiro[1,3-dioxolane-2,3′-[5,10]epoxycyclopenta[a]phenantren]-17′-one;(5α,10α)-5,10-Epoxy-estr-9(11)-ene-3,17-dione Cyclic 3-(1,2-Ethanediyl Acetal), CAS 39931-87-8;(5'R,8'S,10'R,13'S,14'S)-13'-methyl-1',2',6',7',8',12',13',14',15',16'-decahydro-4'H,17'H-spiro[[1,3]dioxolane-2,3'-[5,10]epoxycyclopenta[a]phenanthren]-17'-one |
| CAS号 | 39931-87-8 |
| 分子式 | C20H26O4 |
| 分子量 | 330.42 |
| EINECS号 | 821-898-8 |
| 相关类别 | Intermediates;Steroids;Intermediates, Steroids |
| Mol文件 | 39931-87-8.mol |
| 结构式 |  |
(5α,10α)-5,10-Epoxy-estr-9(11)-ene-3,17-dione Cyclic 3-(1,2-Ethanediyl Acetal) 性质
| 熔点 | 135-139°C |
|---|---|
| 沸点 | 499.1±45.0 °C(Predicted) |
| 密度 | 1.29±0.1 g/cm3(Predicted) |
| 储存条件 | Refrigerator |
| 溶解度 | 可溶于氯仿、可溶于二氯甲烷、乙酸乙酯 |
| 形态 | 固体 |
| 颜色 | 淡黄色低 |
| PH值 | 9.01 at 24.5℃ and 1000g/L |
| InChI | InChI=1/C20H26O4/c1-17-6-5-15-13(14(17)2-3-16(17)21)4-7-18-12-19(22-10-11-23-19)8-9-20(15,18)24-18/h5,13-14H,2-4,6-12H2,1H3/t13-,14+,17-,18-,20-/s3 |
| InChIKey | BAMMJXIMVWLRCU-KMXXOIMFNA-N |
| SMILES | C1[C@@]23O[C@@]2(CC[C@H]2[C@H]4CCC(=O)[C@@]4(C)CC=C23)CC2(OCCO2)C1 |&1:1,3,6,7,12,r| |
| LogP | 2.7 at 30℃ and pH5 |