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CAS Number: 35852-58-5
2-chloro-4-(trifluoromethyl)phenol

Structure

2-chloro-4-(trifluoromethyl)phenol
Name: 2-chloro-4-(trifluoromethyl)phenol
Synonyms:
General Information
Product Number: 35852585
CAS Registry Number: 35852-58-5
Name:
Phenol, 2-​chloro-​4-​(trifluoromethyl)​-
2-​Chloro-​4-​(trifluoromethyl)​phenol; 2-​Chloro-​α,​α,​α-​trifluoro-​p-​cresol 
 
Chemical Formula: C7H4ClF3O
Exact Mass: 195.99
Molecular Weight: 196.55
m/z: 195.99 (100.0%), 197.99 (32.2%), 196.99 (7.6%), 198.99 (2.4%)
Elemental Analysis: C, 42.77; H, 2.05; Cl, 18.04; F, 29.00; O, 8.14
 
InChI: InChI=1S/C7H4ClF3O/c8-5-3-4(7(9,10)11)1-2-6(5)12/h1-3,12H
InChIKey: YNWKEXMSQQUMEL-UHFFFAOYSA-N
Canonical SMILES : C1=CC(=C(C=C1C(F)(F)F)Cl)O

Specification

98%

References
  1. (1) Barluenga, Jose; Journal of the American Chemical Society 2009, V131(11), P4031-4041 CAPLUS
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