5-(1,1-Dimethylethyl)-α,α-dimethyl-2-(phenylmethoxy)benzeneacetonitrile

CAS Registry Number®

1246213-27-3
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CAS Name

5-(1,1-Dimethylethyl)-α,α-dimethyl-2-(phenylmethoxy)benzeneacetonitrile

Molecular Formula

C21H25NO

Molecular Mass

307.43

Cite this Page

5-(1,1-Dimethylethyl)-α,α-dimethyl-2-(phenylmethoxy)benzeneacetonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1246213-27-3 (retrieved 2024-08-14) (CAS RN: 1246213-27-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H25NO/c1-20(2,3)17-11-12-19(18(13-17)21(4,5)15-22)23-14-16-9-7-6-8-10-16/h6-13H,14H2,1-5H3

InChIKey

InChIKey=OQNXXSOKIYYHPZ-UHFFFAOYSA-N

SMILES

C(C#N)(C)(C)C1=C(OCC2=CC=CC=C2)C=CC(C(C)(C)C)=C1

Canonical SMILES

N#CC(C1=CC(=CC=C1OCC=2C=CC=CC2)C(C)(C)C)(C)C

Other Names for this Substance

  • Benzeneacetonitrile, 5-(1,1-dimethylethyl)-α,α-dimethyl-2-(phenylmethoxy)-
  • 5-(1,1-Dimethylethyl)-α,α-dimethyl-2-(phenylmethoxy)benzeneacetonitrile
  • 2-(2-(Benzyloxy)-5-tert-butylphenyl)-2-methylpropanenitrile
  • 2-(5-tert-Butyl-2-phenylmethoxyphenyl)-2-methylpropanenitrile