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4-Methyl-3-(trifluoromethyl)benzoic acid

Catalog Number ACM261952016
CAS Number 261952-01-6
Synonyms 5-Carboxy-2-methylbenzotrifluoride
IUPAC Name 4-methyl-3-(trifluoromethyl)benzoic acid
Molecular Weight 204.15
Molecular Formula C9H7F3O2
Canonical SMILES CC1=C(C=C(C=C1)C(=O)O)C(F)(F)F
InChI InChI=1S/C9H7F3O2/c1-5-2-3-6(8(13)14)4-7(5)9(10,11)12/h2-4H,1H3,(H,13,14)
InChI Key CAPKAYDTKWGFQB-UHFFFAOYSA-N
Boiling Point 268.6±40.0 ºC
Melting Point 182-186 ºC
Purity 98%+
Density 1.345±0.06 g/ml