1-[4-(1,1-Dimethylethyl)phenyl]-2,2,2-trifluoroethanone
CAS Registry Number®
73471-97-3
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CAS Name
1-[4-(1,1-Dimethylethyl)phenyl]-2,2,2-trifluoroethanoneMolecular Formula
C12H13F3OMolecular Mass
230.23Cite this Page
1-[4-(1,1-Dimethylethyl)phenyl]-2,2,2-trifluoroethanone. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=73471-97-3 (retrieved ) (CAS RN: 73471-97-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
108 °C @ Press: 13 TorrMelting Point (2)
38-42 °C
Source(s)
- (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.
- (2) Konno, Tsutomu; Journal of Organic Chemistry, (2006), 71(9), 3545-3550, CAplus
Other Names and Identifiers
InChI
InChI=1S/C12H13F3O/c1-11(2,3)9-6-4-8(5-7-9)10(16)12(13,14)15/h4-7H,1-3H3
InChIKey
InChIKey=JGHXRQPPRZMKDB-UHFFFAOYSA-N
SMILES
C(C(F)(F)F)(=O)C1=CC=C(C(C)(C)C)C=C1
Canonical SMILES
O=C(C1=CC=C(C=C1)C(C)(C)C)C(F)(F)F
Other Names for this Substance
- Ethanone, 1-[4-(1,1-dimethylethyl)phenyl]-2,2,2-trifluoro-
- 1-[4-(1,1-Dimethylethyl)phenyl]-2,2,2-trifluoroethanone
- (p-Tert-Butyl)trifluoroacetophenone
- 4-tert-Butyl-α,α,α-trifluoroacetophenone
- α,α,α-Trifluoro-p-tert-butylacetophenone
