Estr-4-en-17-one

CAS Registry Number®

3646-28-4
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CAS Name

Estr-4-en-17-one

Molecular Formula

C18H26O

Molecular Mass

258.40

Cite this Page

Estr-4-en-17-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3646-28-4 (retrieved 2024-06-26) (CAS RN: 3646-28-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    113-115 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C18H26O/c1-18-11-10-14-13-5-3-2-4-12(13)6-7-15(14)16(18)8-9-17(18)19/h4,13-16H,2-3,5-11H2,1H3/t13-,14+,15+,16-,18-/m0/s1

InChIKey

InChIKey=OLYAEHZZXXLNQQ-QXUSFIETSA-N

SMILES

C[C@@]12[C@]([C@]3([C@@]([C@@]4(C(CC3)=CCCC4)[H])(CC1)[H])[H])(CCC2=O)[H]

Canonical SMILES

O=C1CCC2C3CCC4=CCCCC4C3CCC12C

Other Names for this Substance

  • Estr-4-en-17-one
  • Estrenone

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