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CAS Number: 267242-09-1
4-cyano-2-(trifluoromethyl)benzoic acid

Structure

4-cyano-2-(trifluoromethyl)benzoic acid
Name: 4-cyano-2-(trifluoromethyl)benzoic acid
Synonyms:
General Information
Product Number: 267242091

CAS Registry Number 267242-09-1
Name:
Benzoic acid, 4-​cyano-​2-​(trifluoromethyl)​-

 

Chemical Formula: C9H4F3NO2
Exact Mass: 215.02
Molecular Weight: 215.13
m/z: 215.02 (100.0%), 216.02 (10.2%)

 

InChI:InChI=1S/C9H4F3NO2/c10-9(11,12)7-3-5(4-13)1-2-6(7)8(14)15/h1-3H,(H,14,15)

InChI Key:GRUPENLXDNWNIV-UHFFFAOYSA-N

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

 

Thermal Properties Value Condition Note
Melting Point 169-170 °C Solv: ethanol (64-17-5) (1)CAS

Specification

98%

References

(1) Inukai, Kan; Kogyo Kagaku Zasshi 1965, V68(2), P315-18 CAPLUS

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