Methyl 4-cyanobenzenebutanoate

CAS Registry Number®

20637-03-0

CAS Name

Methyl 4-cyanobenzenebutanoate

Molecular Formula

C12H13NO2

Molecular Mass

203.24

Cite this Page

Methyl 4-cyanobenzenebutanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=20637-03-0 (retrieved 2024-11-29) (CAS RN: 20637-03-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H13NO2/c1-15-12(14)4-2-3-10-5-7-11(9-13)8-6-10/h5-8H,2-4H2,1H3

InChIKey

InChIKey=LUGWUGOOOXSQFQ-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

N#CC1=CC=C(C=C1)CCCC(=O)OC

Other Names for this Substance

  • Benzenebutanoic acid, 4-cyano-, methyl ester
  • Butyric acid, 4-(p-cyanophenyl)-, methyl ester
  • Methyl 4-cyanobenzenebutanoate
  • Methyl 4-(4-cyanophenyl)butanoate

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