16-Dehydropregnenolone acetate

About This Item

Molecular Formula	C₂₃H₃₂O₃
CAS Number	979-02-2

FC-0295104

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Properties

Chemical Identifiers

IUPAC Name	[(3S,8R,9S,10R,13S,14S)-17-acetyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
SMILES	CC(=O)C1=CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C)C)C
InChI Key	MZWRIOUCMXPLKV-RFOVXIPZSA-N
InChI	InChI=1S/C23H32O3/c1-14(24)19-7-8-20-18-6-5-16-13-17(26-15(2)25)9-11-22(16,3)21(18)10-12-23(19,20)4/h5,7,17-18,20-21H,6,8-13H2,1-4H3/t17-,18-,20-,21-,22-,23+/m0/s1

Physical Properties

Boiling Point	464.4±45.0 °C at 760 mmHg
Melting Point	170-178ºC
Flash Point	200.1±28.8 °C
Density	1.1±0.1 g/cm3

Safety Information

Hazard Class

Danger

Flash Point

200.1±28.8 °C

Control Level

Please refer to the Safety Data Sheet (SDS) for complete handling, storage, and disposal instructions. Follow all applicable regulations when working with this chemical reagent.