CAS Registry Number: 56046-25-4
 Name:

9-benzyl-2-chloro-9H-purin-6-amine

6-amino-9-benzyl-2-chloropurine

Chemical Formula: C12H10ClN5
Exact Mass: 259.06
Molecular Weight: 259.69
m/z: 259.06 (100.0%), 261.06 (32.2%), 260.07 (13.1%), 262.06 (4.7%), 260.06 (1.8%)

InChI
InChI=1S/C12H10ClN5/c13-12-16-10(14)9-11(17-12)18(7-15-9)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H2,14,16,17)
InChI Key
HMCPIAFQZBMKOP-UHFFFAOYSA-N
Canonical SMILES
C1=CC=C(C=C1)CN2C=NC3=C2N=C(N=C3N)Cl

Specification

98%

PCT Int. Appl., 2015002754, 08 Jan 2015

Tetrahedron Letters, 56(2), 458-460; 2015