Estra-1,3,5,7,9-Pentaene-3,17.β.-Diol

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Properties Simple | Detailed

Formula C18H20O2
IUPAC Name (13s,14s,17s)-13-methyl-11,12,14,15,16,17-hexahydrocyclopenta[a]phenanthrene-3,17-diol
Molecular Mass 268.350 g·mol−1
Heat of Formation -303.0 ± 16.7 kJ·mol−1
Dipole Moment 1.74 ± 1.08 D
Volume 329.44 Å 3
Surface Area 280.87 Å 2
HOMO Energy -8.55 ± 0.55 eV
LUMO Energy -0.57 ± eV
Point Group Symmetry C1
Synonyms
  • 17-dihydroequilenin
  • beta-dihydroequilenin
  • beta-dihydroequilenina [spanish]
  • beta-estra-1,3,5,7,9-pentaen-3,17-diol
  • estra-1,3,5,7,9-pentaene-3,17beta-diol
CAS Number(s)
  • 1423-97-8
InChIKey RYWZPRVUQHMJFF-BZSNNMDCSA-N
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