6-Bromoandrostenedione

CAS	38632-00-7
Structure
IUPAC Name	(6R,8R,9S,10R,13S,14S)-6-Bromo-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione
Molecular Weight	365.3
Canonical SMILES	CC12CCC3C(C1CCC2=O)CC(C4=CC(=O)CCC34C)Br
InChI	InChI=1S/C19H25BrO2/c1-18-7-5-11(21)9-15(18)16(20)10-12-13-3-4-17(22)19(13,2)8-6-14(12)18/h9,12-14,16H,3-8,10H2,1-2H3/t12-,13-,14-,16+,18+,19-/m0/s1
InChI Key	HAWQRBIGKRAICT-DQXCSHPPSA-N
Boiling Point	467.0±45.0 °C
Melting Point	158-163 °C
Purity	95%+
Density	1.35±0.1 g/cm³
Exact Mass	364.10379
Isomeric SMILES	C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)C[C@H](C4=CC(=O)CC[C@]34C)Br
Monoisotopic Mass	364.10379
Physical State	Solid
Storage Conditions	Inert atmosphere
Topological Polar Surface Area	34.1 Ų