6-Dehydroestrone

CAS Registry Number®

2208-12-0
No image available.

CAS Name

6-Dehydroestrone

Molecular Formula

C18H20O2

Molecular Mass

268.35

Cite this Page

6-Dehydroestrone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?ref=2208-12-0 (retrieved 2024-04-26) (CAS RN: 2208-12-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    261-263 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C18H20O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h2-5,10,14-16,19H,6-9H2,1H3/t14-,15-,16+,18+/m1/s1

InChIKey

InChIKey=WTRRIQCGCGCMQA-CBZIJGRNSA-N

SMILES

C[C@@]12[C@]([C@]3([C@@](C=4C(C=C3)=CC(O)=CC4)(CC1)[H])[H])(CCC2=O)[H]

Canonical SMILES

O=C1CCC2C3C=CC=4C=C(O)C=CC4C3CCC12C

Other Names for this Substance

  • Estra-1,3,5(10),6-tetraen-17-one, 3-hydroxy-
  • 3-Hydroxyestra-1,3,5(10),6-tetraen-17-one
  • Dehydro-estrone
  • Δ6-Estrone
  • Δ6,7-Estrone

View All

CAS INSIGHTSTM
Insights teaser
Insights teaser
Insights teaser
Insights teaser