CAS Registry Number: 913836-03-0

Name:

3-​Pyridinecarboxylic acid, 5-​borono-
5-​(Dihydroxyboryl)​-​3-​pyridinecarboxylic acid; 5-​(Dihydroxyboryl)​nicotinic acid 

Chemical Formula: C6H6BNO4
Exact Mass: 167.04
Molecular Weight: 166.93
m/z: 167.04 (100.0%), 166.04 (24.8%), 168.04 (7.0%), 167.05 (1.7%)

InChI: InChI=1S/C6H6BNO4/c9-6(10)4-1-5(7(11)12)3-8-2-4/h1-3,11-12H,(H,9,10)
InChIKey: XKDATYTUCBKUQZ-UHFFFAOYSA-N
Canonical SMILES : B(C1=CC(=CN=C1)C(=O)O)(O)O

Specification

98%

PCT Int. Appl. (2012), WO 2012125886 A1 20120920. 

PCT Int. Appl. (2012), WO 2012037108 A1 20120322.