6-Ketoestrone

CAS Registry Number®

1476-34-2

CAS Name

6-Ketoestrone

Molecular Formula

C18H20O3

Molecular Mass

284.35

Cite this Page

6-Ketoestrone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1476-34-2 (retrieved 2024-11-22) (CAS RN: 1476-34-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    246-247 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C18H20O3/c1-18-7-6-12-11-3-2-10(19)8-14(11)16(20)9-13(12)15(18)4-5-17(18)21/h2-3,8,12-13,15,19H,4-7,9H2,1H3/t12-,13-,15+,18+/m1/s1

InChIKey

InChIKey=JOVYPIGRPWIXHQ-ONUSSAAZSA-N

SMILES

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

Canonical SMILES

O=C1C2=CC(O)=CC=C2C3CCC4(C(=O)CCC4C3C1)C

Other Names for this Substance

  • Estra-1,3,5(10)-triene-6,17-dione, 3-hydroxy-
  • 3-Hydroxyestra-1,3,5(10)-triene-6,17-dione
  • 6-Ketoestrone
  • 6-Oxoestrone

CAS INSIGHTSTM
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