CAS Registry Number: 90905-62-7

Name:

2-​Pyrimidinecarboxalde​hyde, 5-​methyl-
5-​Methylpyrimidine-​2-​carboxaldehyde 

Chemical Formula: C6H6N2O
Exact Mass: 122.05
Molecular Weight: 122.12
m/z: 122.05 (100.0%), 123.05 (7.3%)
Elemental Analysis: C, 59.01; H, 4.95; N, 22.94; O, 13.10

InChI: InChI=1S/C6H6N2O/c1-5-2-7-6(4-9)8-3-5/h2-4H,1H3
InChIKey: OBPDHHJZPOGJPO-UHFFFAOYSA-N
Canonical SMILES : CC1=CN=C(N=C1)C=O

Specification

98%

PCT Int. Appl. (2013), WO 2013142269 A1 20130926.                                 

Journal of Medicinal Chemistry (2012), 55(21), 9045-9054.