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CAS Number: 312325-75-0
6-(cyanomethyl)picolinic acid

Structure

6-(cyanomethyl)picolinic acid
Name: 6-(cyanomethyl)picolinic acid
Synonyms:
General Information
Product Number: 312325750
CAS Registry Number: 312325-75-0
Name:
        2-​Pyridinecarboxylic acid, 6-​(cyanomethyl)​-
 
Chemical Formula: C8H6N2O2
Exact Mass: 162.04
Molecular Weight: 162.15
m/z: 162.04 (100.0%), 163.05 (8.8%)
Elemental Analysis: C, 59.26; H, 3.73; N, 17.28; O, 19.73
 
InChI: InChI=1S/C8H6N2O2/c9-5-4-6-2-1-3-7(10-6)8(11)12/h1-3H,4H2,(H,11,12)
InChIKey: OHCPKZWRMPEWJZ-UHFFFAOYSA-N
Canonical SMILES : C1=CC(=NC(=C1)CC#N)C(=O)O

Specification

98%

References

PCT Int. Appl. (2014), WO 2014015993 A1 20140130.

Eur. Pat. Appl. (2014), EP 2690102 A1 20140129.                                 

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