CAS Registry Number: 141602-27-9

Name:

Pyrimidine, 5-​bromo-​4-​chloro-​6-​ethyl-

Chemical Formula: C6H6BrClN2
Exact Mass: 219.94
Molecular Weight: 221.48
m/z: 221.94 (100.0%), 219.94 (77.3%), 223.94 (24.3%), 222.94 (7.1%), 220.94 (5.6%), 224.94 (1.6%)

InChI: InChI=1S/C7H10N4O.C2HF3O2/c1-5-10-7(12-11-5)6-2-8-4-9-3-6;3-2(4,5)1(6)7/h4,6H,2-3H2,1H3,(H,8,9);(H,6,7)
InChIKey: VNNPKITYMMVTIG-UHFFFAOYSA-N
Canonical SMILES : CC1=NOC(=N1)C2CNC=NC2.C(=O)(C(F)(F)F)O

Specification

98%

PCT Int. Appl. (2001), WO 2001010843 A1 20010215.                                  

PCT Int. Appl. (2000), WO 2000007998 A1 20000217.