Ethynodiol Diacetate

Molecule SVG Image

Properties Simple | Detailed

Formula C24H32O4
IUPAC Name [(3s,8r,9s,10r,13s,14s,17r)-17-acetoxy-17-ethynyl-13-methyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1h-cyclopenta[a]phenanthren-3-yl] acetate
Molecular Mass 384.508 g·mol−1
Heat of Formation -650.0 ± 16.7 kJ·mol−1
Dipole Moment 3.42 ± 1.08 D
Volume 464.05 Å 3
Surface Area 378.41 Å 2
HOMO Energy -9.49 ± 0.55 eV
LUMO Energy 0.90 ± eV
Point Group Symmetry C1
Synonyms
  • (3-beta,17-alpha)-19-norpregn-4-en-20-yne-3,17-diol diacetate
  • (3beta,17beta)-17-ethynylestr-4-ene-3,17-diyl diacetate
  • 17-alpha-ethynyl-19-norandrost-4-ene-3-beta,17-beta-diol diacetate
  • 17-alpha-ethynyl-3,17-dihydroxy-4-estrene diacetate
  • 17-alpha-ethynyl-4-estrene-3-beta,17-beta-diol diacetate
  • 17-alpha-ethynylestr-4-ene-3-beta,17-beta-diol acetate
  • 19-nor-17-alpha-pregn-4-en-20-yne-3-beta,17-diol diacetate
  • 19-nor-17alpha-pregn-4-en-20-yne-3beta,17-diol diacetate
  • 19-norpregn-4-en-20-yn-3beta,17alpha-diol, diacetate
  • 19-norpregn-4-en-20-yne-3,17-diol, diacetate, (3beta,17alpha)-
  • 3-beta, 17-beta-diacetoxy-17-alpha-ethynyl-4-oestrene
  • 3-beta,17-beta-diacetoxy-19-nor-17-alpha-pregn-4-en-20-yne
  • 3beta,17beta-diacetoxy-17alpha-ethynyl-4-estrene
  • 8080 c. b.
  • [(3s,8r,9s,10r,13s,14s,17r)-17-acetoxy-17-ethynyl-13-methyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1h-cyclopenta[a]phenanthren-3-yl] acetate
  • [(3s,8r,9s,10r,13s,14s,17r)-17-acetyloxy-17-ethynyl-13-methyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1h-cyclopenta[a]phenanthren-3-yl] acetate
  • [(3s,8r,9s,10r,13s,14s,17r)-17-acetyloxy-17-ethynyl-13-methyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1h-cyclopenta[a]phenanthren-3-yl] ethanoate
  • acetic acid [(3s,8r,9s,10r,13s,14s,17r)-17-acetoxy-17-ethynyl-13-methyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1h-cyclopenta[a]phenanthren-3-yl] ester
  • bpbio1_000832
  • cervicundin
  • continuin
  • d01294
  • ethinodiol diacetate
  • ethynodiol diacetate (jan/usp)
  • ethynodiol diacetate [progestins]
  • etynodiol di(acetate)
  • femulen
  • lmst02030124
  • luto-metrodiol
  • metrodiol
  • metrodiol diacetate
  • ovulen 50
  • sc 11800
CAS Number(s)
  • 297-76-7
InChIKey ONKUMRGIYFNPJW-KIEAKMPYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O