CAS Registry Number: 1016241-64-7

Name:

7H-​Pyrrolo[2,​3-​d]​pyrimidine-​6-​carboxylic acid

Chemical Formula: C7H5N3O2
Exact Mass: 163.04
Molecular Weight: 163.13
m/z: 163.04 (100.0%), 164.04 (8.8%)

InChI: InChI=1S/C7H5N3O2/c11-7(12)5-1-4-2-8-3-9-6(4)10-5/h1-3H,(H,11,12)(H,8,9,10)
InChIKey: HHZKYTGSMOMGOQ-UHFFFAOYSA-N
Canonical SMILES : C1=C(NC2=NC=NC=C21)C(=O)O

Specification

98%

PCT Int. Appl. (2010), WO 2010101128 A1 20100910. 

PCT Int. Appl. (2008), WO 2008019357 A2 20080214.