4-[3-(1,1-Dimethylethyl)-1,2,4-oxadiazol-5-yl]benzonitrile

CAS Registry Number®

1135282-95-9
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CAS Name

4-[3-(1,1-Dimethylethyl)-1,2,4-oxadiazol-5-yl]benzonitrile

Molecular Formula

C13H13N3O

Molecular Mass

227.26

Cite this Page

4-[3-(1,1-Dimethylethyl)-1,2,4-oxadiazol-5-yl]benzonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1135282-95-9 (retrieved 2024-09-08) (CAS RN: 1135282-95-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H13N3O/c1-13(2,3)12-15-11(17-16-12)10-6-4-9(8-14)5-7-10/h4-7H,1-3H3

InChIKey

InChIKey=XJCNCHBSTYIKSH-UHFFFAOYSA-N

SMILES

C(C)(C)(C)C=1N=C(ON1)C2=CC=C(C#N)C=C2

Canonical SMILES

N#CC=1C=CC(=CC1)C2=NC(=NO2)C(C)(C)C

Other Names for this Substance

  • Benzonitrile, 4-[3-(1,1-dimethylethyl)-1,2,4-oxadiazol-5-yl]-
  • 4-[3-(1,1-Dimethylethyl)-1,2,4-oxadiazol-5-yl]benzonitrile