3,5-Dimethoxy-β-oxobenzenepropanenitrile

CAS Registry Number®

70988-04-4

CAS Name

3,5-Dimethoxy-β-oxobenzenepropanenitrile

Molecular Formula

C11H11NO3

Molecular Mass

205.21

Cite this Page

3,5-Dimethoxy-β-oxobenzenepropanenitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=70988-04-4 (retrieved 2024-11-25) (CAS RN: 70988-04-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    123.2-124.4 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H11NO3/c1-14-9-5-8(11(13)3-4-12)6-10(7-9)15-2/h5-7H,3H2,1-2H3

InChIKey

InChIKey=LKMXJVUYRSDTPZ-UHFFFAOYSA-N

SMILES

C(CC#N)(=O)C1=CC(OC)=CC(OC)=C1

Canonical SMILES

N#CCC(=O)C=1C=C(OC)C=C(OC)C1

Other Names for this Substance

  • Benzenepropanenitrile, 3,5-dimethoxy-β-oxo-
  • 3,5-Dimethoxy-β-oxobenzenepropanenitrile
  • 3,5-Dimethoxybenzoylacetonitrile

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