Androst-4-ene-17-carboxylicacid, 17-hydroxy-3,11-dioxo-, (17a)- (9CI)

Modify Date: 2025-10-21 16:37:43

Androst-4-ene-17-carboxylicacid, 17-hydroxy-3,11-dioxo-, (17a)- (9CI) Structure
Androst-4-ene-17-carboxylicacid, 17-hydroxy-3,11-dioxo-, (17a)- (9CI) structure
Common Name Androst-4-ene-17-carboxylicacid, 17-hydroxy-3,11-dioxo-, (17a)- (9CI)
CAS Number 3597-44-2 Molecular Weight 346.41700
Density 1.31g/cm3 Boiling Point 567.7ºC at 760 mmHg
Molecular Formula C20H26O5 Melting Point N/A
MSDS N/A Flash Point 311.2ºC

 Names

Name 17-hydroxy-10,13-dimethyl-3,11-dioxo-1,2,6,7,8,9,12,14,15,16-decahydrocyclopenta[a]phenanthrene-17-carboxylic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.31g/cm3
Boiling Point 567.7ºC at 760 mmHg
Molecular Formula C20H26O5
Molecular Weight 346.41700
Flash Point 311.2ºC
Exact Mass 346.17800
PSA 91.67000
LogP 2.51300
Index of Refraction 1.593
InChIKey CULWSMXOZXJGRW-UHFFFAOYSA-N
SMILES CC12CCC(=O)C=C1CCC1C2C(=O)CC2(C)C1CCC2(O)C(=O)O

 Synthetic Route

~%

Androst-4-ene-17-carboxylicacid, 17-hydroxy-3,11-dioxo-, (17a)- (9CI) Structure

Androst-4-ene-1...

CAS#:3597-44-2

Literature: Duke University Patent: US5646136 A1, 1997 ;

~%

Androst-4-ene-17-carboxylicacid, 17-hydroxy-3,11-dioxo-, (17a)- (9CI) Structure

Androst-4-ene-1...

CAS#:3597-44-2

Literature: Caspi,E.; Zajac,H. Journal of the Chemical Society, 1964 , p. 586 - 591

 Precursor & DownStream

Precursor  1

DownStream  2

 Synonyms

17-hydroxy-3,11-dioxo-21-nor-pregnen-(4)-oic acid-(20)
17-Hydroxy-3,11-dioxo-21-nor-pregnen-(4)-saeure-(20)
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