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CAS Number: 628691-93-0
2-chloro-3-fluoroisonicotinic acid

Structure

2-chloro-3-fluoroisonicotinic acid
Name: 2-chloro-3-fluoroisonicotinic acid
Synonyms:
General Information
Product Number: 628691930
CAS Registry Number: 628691-93-0
Name:
        4-​Pyridinecarboxylic acid, 2-​chloro-​3-​fluoro-
        2-​Chloro-​3-​fluoroisonicotinic acid; 2-​Chloro-​3-​fluoropyridine-​4-​carboxylic acid 
 
Chemical Formula: C6H3ClFNO2
Exact Mass: 174.98
Molecular Weight: 175.54
m/z: 174.98 (100.0%), 176.98 (32.0%), 175.99 (6.6%), 177.98 (2.2%)
Elemental Analysis: C, 41.05; H, 1.72; Cl, 20.20; F, 10.82; N, 7.98; O, 18.23
 
InChI: InChI=1S/C6H3ClFNO2/c7-5-4(8)3(6(10)11)1-2-9-5/h1-2H,(H,10,11)
InChIKey: NWNWBLRKHOVSEL-UHFFFAOYSA-N
Canonical SMILES : C1=CN=C(C(=C1C(=O)O)F)Cl
 

Specification

98%

References

PCT Int. Appl. (2013), WO 2013170112 A1 20131114.

PCT Int. Appl. (2012), WO 2012093101 A1 20120712.

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