1,1-Dimethylethyl 4-cyanobenzenepropanoate

CAS Registry Number®

91574-47-9
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CAS Name

1,1-Dimethylethyl 4-cyanobenzenepropanoate

Molecular Formula

C14H17NO2

Molecular Mass

231.29

Cite this Page

1,1-Dimethylethyl 4-cyanobenzenepropanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=91574-47-9 (retrieved 2024-08-23) (CAS RN: 91574-47-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H17NO2/c1-14(2,3)17-13(16)9-8-11-4-6-12(10-15)7-5-11/h4-7H,8-9H2,1-3H3

InChIKey

InChIKey=BEFRPENLYMDRND-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzenepropanoic acid, 4-cyano-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 4-cyanobenzenepropanoate