CAS Registry Number: 903129-71-5

Name:

6H-​Pyrrolo[3,​4-​d]​pyrimidine-​6-​carboxylic acid, 2,​4-​dichloro-​5,​7-​dihydro-​, 1,​1-​dimethylethyl ester
tert-​Butyl 2,​4-​dichloro-​5H-​pyrrolo[3,​4-​d]​pyrimidine-​6(7H)​-​carboxylate 

Chemical Formula: C11H13Cl2N3O2
Exact Mass: 289.04
Molecular Weight: 290.15
m/z: 289.04 (100.0%), 291.04 (64.5%), 290.04 (13.2%), 293.03 (10.2%), 292.04 (7.8%), 294.04 (1.3%)

InChI: InChI=1S/C11H13Cl2N3O2/c1-11(2,3)18-10(17)16-4-6-7(5-16)14-9(13)15-8(6)12/h4-5H2,1-3H3
InChIKey: WUYSMOCOXBLFKK-UHFFFAOYSA-N
Canonical SMILES : CC(C)(C)OC(=O)N1CC2=C(C1)N=C(N=C2Cl)Cl

Specification

98%

PCT Int. Appl. (2014), WO 2014015291 A1 20140123.

PCT Int. Appl. (2012), WO 2012136622 A1 20121011.