CAS Registry Number: 1106295-93-5

Name:

5-​Pyrimidinecarbonitri​le, 2-​chloro-​4-​methoxy-

Chemical Formula: C6H4ClN3O
Exact Mass: 169.00
Molecular Weight: 169.57
m/z: 169.00 (100.0%), 171.00 (32.0%), 170.01 (6.6%), 172.00 (2.4%), 170.00 (1.1%)

InChI: InChI=1S/C6H4ClN3O/c1-11-5-4(2-8)3-9-6(7)10-5/h3H,1H3
InChIKey: YIGFAXAWUVBGGI-UHFFFAOYSA-N
Canonical SMILES : COC1=NC(=NC=C1C#N)Cl

Specification

98%

PCT Int. Appl. (2013), WO 2013079494 A1 20130606. 

PCT Int. Appl. (2011), WO 2011151360 A1 20111208.