4-Methoxy-3,5-dimethyl-β-oxobenzenepropanenitrile

CAS Registry Number®

884504-21-6
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CAS Name

4-Methoxy-3,5-dimethyl-β-oxobenzenepropanenitrile

Molecular Formula

C12H13NO2

Molecular Mass

203.24

Cite this Page

4-Methoxy-3,5-dimethyl-β-oxobenzenepropanenitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=884504-21-6 (retrieved 2024-08-10) (CAS RN: 884504-21-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H13NO2/c1-8-6-10(11(14)4-5-13)7-9(2)12(8)15-3/h6-7H,4H2,1-3H3

InChIKey

InChIKey=QGWZAGXIPOHKNA-UHFFFAOYSA-N

SMILES

O(C)C1=C(C)C=C(C(CC#N)=O)C=C1C

Canonical SMILES

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

Other Names for this Substance

  • Benzenepropanenitrile, 4-methoxy-3,5-dimethyl-β-oxo-
  • 4-Methoxy-3,5-dimethyl-β-oxobenzenepropanenitrile
  • 3,5-Dimethyl-4-methoxybenzoylacetonitrile