CAS Registry Number: 885519-33-5

Name:

1H-​Indazole-​6-​carboxylic acid, 4-​iodo-​, methyl ester

Chemical Formula: C9H7IN2O2
Exact Mass: 301.96
Molecular Weight: 302.07
m/z: 301.96 (100.0%), 302.96 (9.9%)

InChI: InChI=1S/C9H7IN2O2/c1-14-9(13)5-2-7(10)6-4-11-12-8(6)3-5/h2-4H,1H3,(H,11,12)
InChIKey: FZBDWCSGYBKAOD-UHFFFAOYSA-N
Canonical SMILES : COC(=O)C1=CC2=C(C=NN2)C(=C1)I

Specification

98%

PCT Int. Appl. (2014), WO 2014042263 A1 20140320.

PCT Int. Appl. (2012), WO 2012124775 A1 20120920.