α-Acetylbenzeneacetonitrile
CAS Registry Number®
4468-48-8
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CAS Name
α-AcetylbenzeneacetonitrileMolecular Formula
C10H9NOMolecular Mass
159.18Cite this Page
α-Acetylbenzeneacetonitrile. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=4468-48-8 (retrieved ) (CAS RN: 4468-48-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
120 °C @ Press: 0.03 TorrMelting Point (2)
90 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C10H9NO/c1-8(12)10(7-11)9-5-3-2-4-6-9/h2-6,10H,1H3
InChIKey
InChIKey=KHNWFTMUBKJWRZ-UHFFFAOYSA-N
SMILES
C(C(C)=O)(C#N)C1=CC=CC=C1
Canonical SMILES
N#CC(C=1C=CC=CC1)C(=O)C
Other Names for this Substance
- Benzeneacetonitrile, α-acetyl-
- Acetoacetonitrile, 2-phenyl-
- α-Acetylbenzeneacetonitrile
- α-Phenylacetoacetonitrile
- 1-Cyano-1-phenylpropan-2-one
Deleted or Replaced CAS Registry Numbers
128252-19-7
