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]benzonitrileMolecular Formula
C17H13NO3Molecular Mass
279.29Cite 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 ) (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