CAS Registry Number: 116387-40-7

Name:

3-​Pyridinecarboxylic acid, 1,​2-​dihydro-​5-​iodo-​2-​oxo-​, methyl ester
3-​Pyridinecarboxylic acid, 5-​iodo-​1,​2-​dihydro-​2-​oxo-​, methyl ester (9CI); 5-​Iodo-​2-​hydroxynicotinic acid methyl ester 

Chemical Formula: C7H6INO3
Exact Mass: 278.94
Molecular Weight: 279.03
m/z: 278.94 (100.0%), 279.94 (8.1%)
Elemental Analysis: C, 30.13; H, 2.17; I, 45.48; N, 5.02; O, 17.20

InChI: InChI=1S/C7H6INO3/c1-12-7(11)5-2-4(8)3-9-6(5)10/h2-3H,1H3,(H,9,10)
InChIKey: LGUKGFMYVHZDEB-UHFFFAOYSA-N
Canonical SMILES : COC(=O)C1=CC(=CNC1=O)I

Specification

98%

1. (1) Taylor, Edward C.; EP 265126 A2 1988 CAPLUS