(3β)-Androsta-5,16-diene-3,17-diol 3-Acetate 17-(Trifluoromethanesulfonate)

Modify Date: 2024-01-03 17:47:31

(3β)-Androsta-5,16-diene-3,17-diol 3-Acetate 17-(Trifluoromethanesulfonate) Structure
(3β)-Androsta-5,16-diene-3,17-diol 3-Acetate 17-(Trifluoromethanesulfonate) structure
Common Name (3β)-Androsta-5,16-diene-3,17-diol 3-Acetate 17-(Trifluoromethanesulfonate)
CAS Number 115375-60-5 Molecular Weight 462.523
Density 1.3±0.1 g/cm3 Boiling Point 491.9±45.0 °C at 760 mmHg
Molecular Formula C22H29F3O5S Melting Point N/A
MSDS N/A Flash Point 251.3±28.7 °C

 Names

Name [(3R,8R,9S,10R,13S,14S)-10,13-dimethyl-17-(trifluoromethylsulfonyloxy)-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.3±0.1 g/cm3
Boiling Point 491.9±45.0 °C at 760 mmHg
Molecular Formula C22H29F3O5S
Molecular Weight 462.523
Flash Point 251.3±28.7 °C
Exact Mass 462.168793
PSA 78.05000
LogP 6.90
Vapour Pressure 0.0±1.2 mmHg at 25°C
Index of Refraction 1.532

 Safety Information

Hazard Codes Xn

 Synthetic Route

~36%

(3β)-Androsta-5,16-diene-3,17-diol 3-Acetate 17-(Trifluoromethanesulfonate) Structure

(3β)-Androsta-5...

CAS#:115375-60-5

Literature: WO2012/83112 A2, ; Page/Page column 181-182 ; WO 2012/083112 A2

~56%

(3β)-Androsta-5,16-diene-3,17-diol 3-Acetate 17-(Trifluoromethanesulfonate) Structure

(3β)-Androsta-5...

CAS#:115375-60-5

Literature: Journal of Medicinal Chemistry, , vol. 38, # 13 p. 2463 - 2471

~%

(3β)-Androsta-5,16-diene-3,17-diol 3-Acetate 17-(Trifluoromethanesulfonate) Structure

(3β)-Androsta-5...

CAS#:115375-60-5

Literature: WO2006/21776 A1, ; Page/Page column 17-20 ;

~%

(3β)-Androsta-5,16-diene-3,17-diol 3-Acetate 17-(Trifluoromethanesulfonate) Structure

(3β)-Androsta-5...

CAS#:115375-60-5

Detail
Literature: WO2006/21776 A1, ; Page/Page column 17-20 ;

~%

(3β)-Androsta-5,16-diene-3,17-diol 3-Acetate 17-(Trifluoromethanesulfonate) Structure

(3β)-Androsta-5...

CAS#:115375-60-5

Literature: WO2012/83112 A2, ; WO 2012/083112 A2

 Synonyms

Methanesulfonic acid, 1,1,1-trifluoro-, (3β)-3-(acetyloxy)androsta-5,16-dien-17-yl ester
(3β)-17-{[(Trifluoromethyl)sulfonyl]oxy}androsta-5,16-dien-3-yl acetate
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