3-[3-(1,3-Dioxolan-2-yl)benzoyl]benzonitrile

CAS Registry Number®

898778-95-5
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CAS Name

3-[3-(1,3-Dioxolan-2-yl)benzoyl]benzonitrile

Molecular Formula

C17H13NO3

Molecular Mass

279.29

Cite this Page

3-[3-(1,3-Dioxolan-2-yl)benzoyl]benzonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=898778-95-5 (retrieved 2024-08-15) (CAS RN: 898778-95-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H13NO3/c18-11-12-3-1-4-13(9-12)16(19)14-5-2-6-15(10-14)17-20-7-8-21-17/h1-6,9-10,17H,7-8H2

InChIKey

InChIKey=JWAPFLUHYYSDSA-UHFFFAOYSA-N

SMILES

C(=O)(C=1C=C(C=CC1)C2OCCO2)C3=CC(C#N)=CC=C3

Canonical SMILES

N#CC1=CC=CC(=C1)C(=O)C2=CC=CC(=C2)C3OCCO3

Other Names for this Substance

  • Benzonitrile, 3-[3-(1,3-dioxolan-2-yl)benzoyl]-
  • 3-[3-(1,3-Dioxolan-2-yl)benzoyl]benzonitrile