3,17-Dioxoandrost-4-En-19-Oic Acid

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Properties Simple | Detailed

Formula C19H24O4
IUPAC Name (8s,9s,10s,13s,14s)-13-methyl-3,17-dioxo-2,6,7,8,9,11,12,14,15,16-decahydro-1h-cyclopenta[a]phenanthrene-10-carboxylic acid
Molecular Mass 316.391 g·mol−1
Heat of Formation -778.9 ± 16.7 kJ·mol−1
Dipole Moment 2.14 ± 1.08 D
Volume 379.81 Å 3
Surface Area 304.35 Å 2
HOMO Energy -9.90 ± 0.55 eV
LUMO Energy -0.43 ± eV
Point Group Symmetry C1
Synonyms
  • (8s,9s,10s,13s,14s)-13-methyl-3,17-dioxo-2,6,7,8,9,11,12,14,15,16-decahydro-1h-cyclopenta[a]phenanthrene-10-carboxylic acid
  • (8s,9s,10s,13s,14s)-3,17-diketo-13-methyl-2,6,7,8,9,11,12,14,15,16-decahydro-1h-cyclopenta[a]phenanthrene-10-carboxylic acid
  • 19-oic-androstenedione
  • 3,17-dioxo-4-androsten-19-oic acid
  • androst-4-en-19-oic acid, 3,17-dioxo-
CAS Number(s)
  • 4757-95-3
InChIKey SCHKUIWXIYXQFK-UNTXSKPGSA-N
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