CAS Registry Number: 1210437-68-5

Name:

1H-​Pyrrolo[2,​3-​b]​pyridine-​3-​carboxylic acid, 5-​bromo-​, ethyl ester

Chemical Formula: C10H9BrN2O2
Exact Mass: 267.98
Molecular Weight: 269.09
m/z: 267.98 (100.0%), 269.98 (97.3%), 268.99 (11.0%), 270.99 (10.8%), 269.99 (1.0%)

InChI: InChI=1S/C10H9BrN2O2/c1-2-15-10(14)8-5-13-9-7(8)3-6(11)4-12-9/h3-5H,2H2,1H3,(H,12,13)
InChIKey: KPWKIXRLVSQXAU-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)C1=CNC2=NC=C(C=C12)Br

Specification

98%

PCT Int. Appl. (2010), WO 2010020308 A1 20100225.                                 

Ger. Offen. (2010), DE 102008038221 A1 20100225.