CAS: 1045-69-8; Testosterone Acetate

英文名称Testosterone Acetate
中文名称醋酸睾酮
IUPAC名称[(8R,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl] acetate
其它别名(17beta)-Hydroxyandrost-4-en-3-one acetate
CAS编号1045-69-8
MFCD编号:MFCD00021154
EINECS号:213-876-6
FDA UNII编号:5652105Y6S
分子式:C21H30O3
分子量:330.46
产品CID: 84578
产品分类原料药 → 激素及调节内分泌功能类药 → 雄激素及同化激素类药

相似结构搜索
InChIKey: DJPZSBANTAQNFN-PXQJOHHUSA-N
InChI=1S/C21H30O3/c1-13(22)24-19-7-6-17-16-5-4-14-12-15(23)8-10-20(14,2)18(16)9-11-21(17,19)3/h12,16-19H,4-11H2,1-3H3/t16-,17-,18-,19-,20-,2…
计算化学: 氢键受体数3.0氢键供体数0.0可旋转键数2.0

物理性质

熔点139 - 141 °C
沸点441.8±45.0 °C at 760 mmHg
闪点191.5±28.8 °C
密度1.1±0.1 g/cm3
PSA:43.37
LogP:4.37
折射率1.541
蒸汽压0.0±1.1 mmHg at 25°C
溶解性Acetonitrile: 1 mg/mL; Ethanol: 1 mg/mL; Methanol: 1 mg/mL
外观形态结晶性固体
储存条件受控物质, -20°C 冷藏
产品应用该化合物用于与经酯化的睾酮相同的用途.

MSDS等安全信息

GHS象形图
GHS符号GHS08 & GHS07;
注释: Health hazard & Exclamation mark
危险类别致癌性类别1B
生殖毒性类别2
急性毒性类别4(经口)
生殖毒性类别1A
水生急性毒性类别1
警示词Danger(危险)
危险描述H350 |可能致癌.
H361 |怀疑对生育能力或胎儿造成损害.
H302 |吞咽有害.
H361fd |怀疑会影响生育能力. 怀疑对胎儿造成损害.
H360 |可能损害生育能力或胎儿.
H400 |对水生生物毒性极大.
防范说明P210-P305+P351+P338
UN编号UN 2811 6.1/PG 2
危险品标志T,Xn,F
安全声明53-22-26-36-36/37-16
危险类别码45-22-63-36-20/21/22-11
WGK Germany3

欧盟法规

ECHA物质ECHA物质C&L通报REACH预注册

上下游产品

合成工艺路线路线简述

合成目标产物 Testosterone Acetate 主要起始原料 Testosterone And Acetic Anhydride
(文献来源)合成步骤主要原料 Testosterone 和 Acetic Anhydride

雄烯二醇置于甲醇,氢氧化钾,溴,溶剂黄146体系中,化学反应生成醋酸睾酮
参考文献:Butenandt; Hanisch,Hoppe-Seyler'S Zeitschrift Fur Physiologische Chemie,1935,Vol. 237,P. 89,95
标题:Butenandt; Hanisch,Hoppe-Seyler'S Zeitschrift Fur Physiologische Chemie,1935,Vol. 237,P. 89,95

海关参考信息

2905191000-3,3-二甲基丁-2-醇
💡 提示：海关信息按照顺序优先匹配，如需确认的海关信息，请参考相关资料。
详情请参考：📖 海关编码查询和海关进出口税则

专利信息

专利号:US-10189765-B2
优先权日:2015-10-30
标题:Process for the preparation of 17Î²-hydroxy-des-A-androst-9,10-en-5-one
发明人：LENNA ROBERTO; DI BRISCO ROBERTO
权利人:IND CHIMICA SRL
摘要:The present invention relates to a new process for the synthesis of 17Î²-hydroxy-des-A-androst-9,10-en-5-one, the compound of the following formula (1), which can be used as an intermediate in the synthesis of retroprogesterones.

专利号:US-3627757-A
优先权日:1964-01-03
标题 :6-alkanoylthio-4-en-3-oxo steroids and process for production thereof
发明人：KOMENO TAICHIRO
权利人:SHIONOGI & CO
摘要:Hormonal 6 Epsilon -lower alkanoylthio-3-oxo-4-en-steroids are prepared from corresponding 6 Epsilon -halo-3-oxo-delta-4steroids and 6 Epsilon -lower alkanoylthio-5-hydroxy-3-oxosteroids. They are also useful as intermediates for synthesis of hormonal thieno-(4'',3'',2''-4,5,6,)steroids which have been disclosed in U.S. Pat. No. 3,300,485.