CAS Registry Number: 1111237-76-3

Name:

7H-​Pyrrolo[2,​3-​d]​pyrimidine, 5-​bromo-​4-​chloro-​2-​methyl-

Chemical Formula: C7H5BrClN3
Exact Mass: 244.94
Molecular Weight: 246.49
m/z: 246.93 (100.0%), 244.94 (77.4%), 248.93 (24.1%), 247.94 (7.6%), 245.94 (5.9%), 249.93 (2.1%), 247.93 (1.1%)

InChI: InChI=1S/C7H5BrClN3/c1-3-11-6(9)5-4(8)2-10-7(5)12-3/h2H,1H3,(H,10,11,12)
InChIKey: XGBXHIJPFPEGBV-UHFFFAOYSA-N
Canonical SMILES : CC1=NC2=C(C(=CN2)Br)C(=N1)Cl

Specification

98%

PCT Int. Appl. (2009), WO 2009016132 A1 20090205.