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CAS Number: 581813-17-4
3-bromo-4-(trifluoromethyl)benzoic acid

Structure

 3-bromo-4-(trifluoromethyl)benzoic acid
Name: 3-bromo-4-(trifluoromethyl)benzoic acid
Synonyms:
General Information
Product Number: 581813174

CAS Registry Number 581813-17-4
Name:
Benzoic acid, 3-?bromo-?4-?(trifluoromethyl)?-
3-Bromo-4-(trifluoromethyl)benzoic acid

 

Chemical Formula: C8H4BrF3O2
Exact Mass: 267.93
Molecular Weight: 269.02
m/z: 267.93 (100.0%), 269.93 (97.3%), 268.94 (8.8%), 270.94 (8.6%)

 

InChI:InChI=1S/C8H4BrF3O2/c9-6-3-4(7(13)14)1-2-5(6)8(10,11)12/h1-3H,(H,13,14)

InChI Key:OWNPWXHFRGDHMC-UHFFFAOYSA-N

Canonical SMILES:C1=CC(=C(C=C1C(=O)O)Br)C(F)(F)F

Specification

98%
References

PCT Int. Appl. (2015), WO 2015106292 A1 20150716.

PCT Int. Appl. (2015), WO 2015034271 A1 20150312.                                 
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