3,4-Dimethoxybenzenepropanenitrile

CAS Registry Number®

49621-56-9
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CAS Name

3,4-Dimethoxybenzenepropanenitrile

Molecular Formula

C11H13NO2

Molecular Mass

191.23

Cite this Page

3,4-Dimethoxybenzenepropanenitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=49621-56-9 (retrieved 2024-06-26) (CAS RN: 49621-56-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    145-150 °C @ Press: 0.8 Torr

  • Melting Point (1)

    46.5 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H13NO2/c1-13-10-6-5-9(4-3-7-12)8-11(10)14-2/h5-6,8H,3-4H2,1-2H3

InChIKey

InChIKey=LECKQPWCSYMCDR-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

N#CCCC1=CC=C(OC)C(OC)=C1

Other Names for this Substance

  • Benzenepropanenitrile, 3,4-dimethoxy-
  • Hydrocinnamonitrile, 3,4-dimethoxy-
  • 3,4-Dimethoxybenzenepropanenitrile
  • β-(3,4-Dimethoxyphenyl)propionitrile
  • NSC 266052

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