16-alpha-Chloroprogesterone structure

16-alpha-Chloroprogesterone

(6S,8S,9S,10R,13S,14S,17S)-17-acetyl-6-chloro-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one

Also Known As: 16-alpha-Chloroprogesterone|16-alpha-Chloropregn-4-ene-3,20-dione|6-Chloropregn-4-ene-3,20-dione|Pregn-4-ene-3,20-dione, 16-alpha-chloro-|6alpha-Chloropregn-4-ene-3,20-dione|(6S,8S,9S,10R,13S,14S,17S)-17-acetyl-6-chloro-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one

CAS: 1816-80-4
Molecular Formula C21H29ClO2
Molecular Weight 348.1856 g/mol
LogP 3.8
Topological Polar Surface Area 34.1 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
Rotatable Bonds 1
Exact Mass 348.1856
Monoisotopic Mass 348.1856
Heavy Atoms 24
Complexity 623.0

Chemical Identifiers

CAS Number 1816-80-4
SMILES CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@@H](C4=CC(=O)CC[C@]34C)Cl)C
InChIKey ICTXWOSKTZKFBH-ADDDSGAWSA-N

Product Overview

16-alpha-Chloroprogesterone (CAS 1816-80-4), with molecular formula C21H29ClO2 and molecular weight 348.1856 g/mol. IUPAC: (6S,8S,9S,10R,13S,14S,17S)-17-acetyl-6-chloro-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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