4-Methoxy-α-(2,2,2-trifluoroacetyl)benzeneacetonitrile
CAS Registry Number®
22102-05-2
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CAS Name
4-Methoxy-α-(2,2,2-trifluoroacetyl)benzeneacetonitrileMolecular Formula
C11H8F3NO2Molecular Mass
243.18Cite this Page
4-Methoxy-α-(2,2,2-trifluoroacetyl)benzeneacetonitrile. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=22102-05-2 (retrieved ) (CAS RN: 22102-05-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
77-79.5 °C
Source(s)
- (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.
Other Names and Identifiers
InChI
InChI=1S/C11H8F3NO2/c1-17-8-4-2-7(3-5-8)9(6-15)10(16)11(12,13)14/h2-5,9H,1H3
InChIKey
InChIKey=LISQJPUFHGKGMA-UHFFFAOYSA-N
SMILES
C(C(C(F)(F)F)=O)(C#N)C1=CC=C(OC)C=C1
Canonical SMILES
N#CC(C(=O)C(F)(F)F)C1=CC=C(OC)C=C1
Other Names for this Substance
- Benzeneacetonitrile, 4-methoxy-α-(2,2,2-trifluoroacetyl)-
- Acetoacetonitrile, 4,4,4-trifluoro-2-(p-methoxyphenyl)-
- Benzeneacetonitrile, 4-methoxy-α-(trifluoroacetyl)-
- 4-Methoxy-α-(2,2,2-trifluoroacetyl)benzeneacetonitrile