CAS Registry Number: 906000-39-3

Name:

1H-​Indazole-​6-​carbonitrile, 3-​iodo-
3-​Iodo-​1H-​indazole-​6-​carbonitrile; 3-​Iodoindazole-​6-​carbonitrile 

Chemical Formula: C8H4IN3
Exact Mass: 268.94
Molecular Weight: 269.04
m/z: 268.94 (100.0%), 269.95 (8.7%), 269.94 (1.1%)
Elemental Analysis: C, 35.71; H, 1.50; I, 47.17; N, 15.62

InChI: InChI=1S/C8H4IN3/c9-8-6-2-1-5(4-10)3-7(6)11-12-8/h1-3H,(H,11,12)
InChIKey: FRYOUXROKRKPQP-UHFFFAOYSA-N
Canonical SMILES : C1=CC2=C(NN=C2C=C1C#N)I

Specification

98%

PCT Int. Appl. (2013), WO 2013030138 A1 20130307.

PCT Int. Appl. (2007), WO 2007088400 A1 20070809.