2-Methoxyestradiol

CAS Registry Number®

362-07-2

CAS Name

2-Methoxyestradiol

Molecular Formula

C19H26O3

Molecular Mass

302.41

Cite this Page

2-Methoxyestradiol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=362-07-2 (retrieved 2024-11-21) (CAS RN: 362-07-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    184-186 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C19H26O3/c1-19-8-7-12-13(15(19)5-6-18(19)21)4-3-11-9-16(20)17(22-2)10-14(11)12/h9-10,12-13,15,18,20-21H,3-8H2,1-2H3/t12-,13+,15-,18-,19-/m0/s1

InChIKey

InChIKey=CQOQDQWUFQDJMK-SSTWWWIQSA-N

SMILES

C[C@@]12[C@]([C@]3([C@@](C=4C(CC3)=CC(O)=C(OC)C4)(CC1)[H])[H])(CC[C@@H]2O)[H]

Canonical SMILES

OC=1C=C2C(=CC1OC)C3CCC4(C)C(O)CCC4C3CC2

Other Names for this Substance

  • Estra-1,3,5(10)-triene-3,17-diol, 2-methoxy-, (17β)-
  • Estra-1,3,5(10)-triene-3,17β-diol, 2-methoxy-
  • Estradiol, 2-methoxy-
  • (17β)-2-Methoxyestra-1,3,5(10)-triene-3,17-diol
  • 2-Methoxyestradiol

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Deleted or Replaced CAS Registry Numbers

916057-22-2