18-Hydroxyandrost-4-Ene-3,17-Dione

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Properties Simple | Detailed

Formula C19H26O3
IUPAC Name (8r,9s,10r,13s,14s)-13-(hydroxymethyl)-10-methyl-2,6,7,8,9,11,12,14,15,16-decahydro-1h-cyclopenta[a]phenanthrene-3,17-dione
Molecular Mass 302.408 g·mol−1
Heat of Formation -604.8 ± 16.7 kJ·mol−1
Dipole Moment 3.71 ± 1.08 D
Volume 377.13 Å 3
Surface Area 301.68 Å 2
HOMO Energy -9.88 ± 0.55 eV
LUMO Energy -0.11 ± eV
Point Group Symmetry C1
Synonyms
  • (8r,9s,10r,13s,14s)-10-methyl-13-methylol-2,6,7,8,9,11,12,14,15,16-decahydro-1h-cyclopenta[a]phenanthrene-3,17-quinone
  • (8r,9s,10r,13s,14s)-13-(hydroxymethyl)-10-methyl-2,6,7,8,9,11,12,14,15,16-decahydro-1h-cyclopenta[a]phenanthrene-3,17-dione
  • 18-hydroxy-4-androstene-3,17-dione
  • 18-oha
  • androst-4-ene-3,17-dione, 18-hydroxy-
CAS Number(s)
  • 7121-60-0
InChIKey ZZHNYTLKRMBVAI-NLPXPOPTSA-N
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