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CAS Number: 67589-15-5
1-(2-hydroxy-5-(trifluoromethyl)phenyl)ethanone

Structure

1-(2-hydroxy-5-(trifluoromethyl)phenyl)ethanone
Name: 1-(2-hydroxy-5-(trifluoromethyl)phenyl)ethanone
Synonyms:
General Information
Product Number: 67589155
CAS Registry Number:
67589-15-5
 Name:
Ethanone, 1-​[2-​hydroxy-​5-​(trifluoromethyl)​phenyl]​-
1-​[2-​Hydroxy-​5-​(trifluoromethyl)​phenyl]​ethanone; 2-​Acetyl-​4-​(trifluoromethyl)​phenol; 2-​Hydroxy-​5-​(trifluoromethyl)​acetophenone; 2'-​Hydroxy-​5'-​trifluoromethylaceto​phenone 
 
Chemical Formula: C9H7F3O2
Exact Mass: 204.04
Molecular Weight: 204.15
m/z: 204.04 (100.0%), 205.04 (9.8%)
Elemental Analysis: C, 52.95; H, 3.46; F, 27.92; O, 15.67
 
InChI: InChI=1S/C9H7F3O2/c1-5(13)7-4-6(9(10,11)12)2-3-8(7)14/h2-4,14H,1H3
InChIKey: BRSHLOIZDJDEPI-UHFFFAOYSA-N
Canonical SMILES : CC(=O)C1=C(C=CC(=C1)C(F)(F)F)O

Specification

98%

References
  1. (1) Fujimoto, Tatsuhiko; Bioorganic & Medicinal Chemistry Letters 2011, V21(21), P6414-6416 CAPLUSPCT Int. Appl. (2012), WO 2012004706 A2 20120112.
  2. PCT Int. Appl. (2011), WO 2011051478 A1 20110505
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