17-Oxo-5α-Androstane

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Properties Simple | Detailed

Formula C19H30O
IUPAC Name (5r,8r,9s,10s,13s,14s)-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one
Molecular Mass 274.441 g·mol−1
Heat of Formation -391.9 ± 16.7 kJ·mol−1
Dipole Moment 3.29 ± 1.08 D
Volume 364.43 Å 3
Surface Area 292.19 Å 2
HOMO Energy -9.62 ± 0.55 eV
LUMO Energy 1.07 ± eV
Point Group Symmetry C1
Synonyms
  • (5r,8r,9s,10s,13s,14s)-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one
  • 17-oxo-5.alpha.-androstane
  • 5alpha-androstan-17-one
  • androstan-17-one
  • androstan-17-one, (5alpha)- (9ci)
CAS Number(s)
  • 963-74-6
InChIKey YJDYCULVYZDESB-HKQXQEGQSA-N
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