3-Methyl-β-oxobenzenepropanenitrile
CAS Registry Number®
53882-81-8
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CAS Name
3-Methyl-β-oxobenzenepropanenitrileMolecular Formula
C10H9NOMolecular Mass
159.18Cite this Page
3-Methyl-β-oxobenzenepropanenitrile. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=53882-81-8 (retrieved ) (CAS RN: 53882-81-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
74-75 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C10H9NO/c1-8-3-2-4-9(7-8)10(12)5-6-11/h2-4,7H,5H2,1H3
InChIKey
InChIKey=IVLKDYOTZMFMLO-UHFFFAOYSA-N
SMILES
C(CC#N)(=O)C1=CC(C)=CC=C1
Canonical SMILES
N#CCC(=O)C1=CC=CC(=C1)C
Other Names for this Substance
- Benzenepropanenitrile, 3-methyl-β-oxo-
- 3-Methyl-β-oxobenzenepropanenitrile
- m-Toluoylacetonitrile
- (3-Methylbenzoyl)acetonitrile
- 3-Oxo-3-m-tolylpropionitrile
