4-Androstene-3α,17Beta-Diol

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Properties Simple | Detailed

Formula C19H30O2
IUPAC Name (3r,8r,9s,10r,13s,14s,17s)-10,13-dimethyl-2,3,6,7,8,9,11,12,14,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthrene-3,17-diol
Molecular Mass 290.440 g·mol−1
Heat of Formation -528.9 ± 16.7 kJ·mol−1
Dipole Moment 2.72 ± 1.08 D
Volume 374.89 Å 3
Surface Area 300.38 Å 2
HOMO Energy -9.62 ± 0.55 eV
LUMO Energy 0.93 ± eV
Point Group Symmetry C1
Synonyms
  • (3alpha,17beta)-androst-4-ene-3,17-diol
  • (3r,8r,9s,10r,13s,14s,17s)-10,13-dimethyl-2,3,6,7,8,9,11,12,14,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthrene-3,17-diol
  • 4-androstene-3,17-diol
CAS Number(s)
  • 1852-61-5
InChIKey BTTWKVFKBPAFDK-KYQPOWKGSA-N
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