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CAS Number: 1200497-81-9
3-chloro-5-cyanopicolinic acid

Structure

3-chloro-5-cyanopicolinic acid
Name: 3-chloro-5-cyanopicolinic acid
Synonyms:
General Information
Product Number: 1200497819

CAS Registry Number: 1200497-81-9

Name:

2-​Pyridinecarboxylic acid, 3-​chloro-​5-​cyano-
3-​Chloro-​5-​cyanopicolinic acid; 3-​Chloro-​5-​cyanopyridine-​2-​carboxylic acid 

 

Chemical Formula: C7H3ClN2O2
Exact Mass: 181.99
Molecular Weight: 182.56
m/z: 181.99 (100.0%), 183.99 (32.4%), 182.99 (8.4%), 184.99 (2.5%)

 

InChI: InChI=1S/C7H3ClN2O2/c8-5-1-4(2-9)3-10-6(5)7(11)12/h1,3H,(H,11,12)
InChIKey: NHQRPMDOQOKWPU-UHFFFAOYSA-N
Canonical SMILES : C1=C(C=NC(=C1Cl)C(=O)O)C#N

Specification

98%

References

PCT Int. Appl. (2014), WO 2014134341 A1 20140904.                                 

PCT Int. Appl. (2013), WO 2013181202 A2 20131205.                                  

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