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CAS Number: 25462-85-5
2-chloro-6-methylisonicotinic acid

Structure

2-chloro-6-methylisonicotinic acid
Name: 2-chloro-6-methylisonicotinic acid
Synonyms:
General Information
Product Number: 25462855
CAS Registry Number: 25462-85-5
Name:
        4-​Pyridinecarboxylic acid, 2-​chloro-​6-​methyl-
        Isonicotinic acid, 2-​chloro-​6-​methyl- (6CI,​8CI); 2-​Chloro-​6-​methyl-​4-​pyridinecarboxylic acid; 2-​Chloro-​6-​methylisonicotinic acid 
 
Chemical Formula: C7H6ClNO2
Exact Mass: 171.01
Molecular Weight: 171.58
m/z: 171.01 (100.0%), 173.01 (32.4%), 172.01 (8.1%), 174.01 (2.5%)
Elemental Analysis: C, 49.00; H, 3.52; Cl, 20.66; N, 8.16; O, 18.65
 
InChI: InChI=1S/C7H6ClNO2/c1-4-2-5(7(10)11)3-6(8)9-4/h2-3H,1H3,(H,10,11)
InChIKey: ZGZMEKHQIZSZOH-UHFFFAOYSA-N
Canonical SMILES : CC1=NC(=CC(=C1)C(=O)O)Cl

Specification

98%

References

PCT Int. Appl. (2014), WO 2014076111 A1 20140522. 

PCT Int. Appl. (2014), WO 2014076091 A1 20140522.                                 

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