3,3-Dimethoxyestra-5(10),9(11)-dien-17-one

CAS Registry Number®

10109-76-9
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CAS Name

3,3-Dimethoxyestra-5(10),9(11)-dien-17-one

Molecular Formula

C20H28O3

Molecular Mass

316.43

Cite this Page

3,3-Dimethoxyestra-5(10),9(11)-dien-17-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=10109-76-9 (retrieved 2024-07-06) (CAS RN: 10109-76-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    112 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C20H28O3/c1-19-10-8-15-14-9-11-20(22-2,23-3)12-13(14)4-5-16(15)17(19)6-7-18(19)21/h8,16-17H,4-7,9-12H2,1-3H3/t16-,17+,19+/m1/s1

InChIKey

InChIKey=YEOAIJNHLPFTRM-AOIWGVFYSA-N

SMILES

C[C@@]12[C@]([C@]3(C(C4=C(CC3)CC(OC)(OC)CC4)=CC1)[H])(CCC2=O)[H]

Canonical SMILES

O=C1CCC2C3C(=CCC12C)C4=C(CC3)CC(OC)(OC)CC4

Other Names for this Substance

  • Estra-5(10),9(11)-dien-17-one, 3,3-dimethoxy-
  • Estra-5(10),9(11)-diene-3,17-dione, 3-(dimethyl acetal)
  • 3,3-Dimethoxyestra-5(10),9(11)-dien-17-one