Pregnane-11,20-dione,3-(acetyloxy)-16-bromo-17-hydroxy-, (3b,5a,16b)- (9CI)

Modify Date: 2025-09-13 21:48:30

Pregnane-11,20-dione,3-(acetyloxy)-16-bromo-17-hydroxy-, (3b,5a,16b)- (9CI) structure	Common Name	Pregnane-11,20-dione,3-(acetyloxy)-16-bromo-17-hydroxy-, (3b,5a,16b)- (9CI)
	CAS Number	1780-97-8	Molecular Weight	469.40900
	Density	1.36g/cm3	Boiling Point	548.2ºC at 760mmHg
	Molecular Formula	C₂₃H₃₃BrO₅	Melting Point	N/A
	MSDS	N/A	Flash Point	285.3ºC

Name	16.β.-Bromo-5.α.-pregnan-3.β.,17.α.-diol-11,20-dione-3-acetate
Synonym	More Synonyms

Density	1.36g/cm3
Boiling Point	548.2ºC at 760mmHg
Molecular Formula	C₂₃H₃₃BrO₅
Molecular Weight	469.40900
Flash Point	285.3ºC
Exact Mass	468.15100
PSA	80.67000
LogP	3.83330
Vapour Pressure	2.67E-14mmHg at 25°C
Index of Refraction	1.563
InChIKey	DHFXZXVWFURDJS-UDHGNGJMSA-N
SMILES	CC(=O)OC1CCC2(C)C(CCC3C2C(=O)CC2(C)C3CC(Br)C2(O)C(C)=O)C1

[(3S,5S,8S,9S,10S,13S,14S,16S,17R)-17-acetyl-16-bromo-17-hydroxy-10,13-dimethyl-11-oxo-2,3,4,5,6,7,8,9,12,14,15,16-dodecahydro-1H-cyclopenta [a]phenanthren-3-yl] acetate

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