1-(3,5-Dimethoxyphenyl)-1-pentanone

CAS Registry Number®

5333-29-9

CAS Name

1-(3,5-Dimethoxyphenyl)-1-pentanone

Molecular Formula

C13H18O3

Molecular Mass

222.28

Cite this Page

1-(3,5-Dimethoxyphenyl)-1-pentanone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=5333-29-9 (retrieved 2024-11-22) (CAS RN: 5333-29-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    175-177 °C

  • Melting Point (2)

    42-43 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C13H18O3/c1-4-5-6-13(14)10-7-11(15-2)9-12(8-10)16-3/h7-9H,4-6H2,1-3H3

InChIKey

InChIKey=XAOSSZOACCZAPC-UHFFFAOYSA-N

SMILES

C(CCCC)(=O)C1=CC(OC)=CC(OC)=C1

Canonical SMILES

O=C(C=1C=C(OC)C=C(OC)C1)CCCC

Other Names for this Substance

  • 1-Pentanone, 1-(3,5-dimethoxyphenyl)-
  • Valerophenone, 3′,5′-dimethoxy-
  • 1-(3,5-Dimethoxyphenyl)-1-pentanone
  • 3,5-Dimethoxyphenyl butyl ketone
  • 3′,5′-Dimethoxyvalerophenone

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