CAS Registry Number: 954112-61-9

Name:

1H-​Pyrrolo[2,​3-​b]​pyridine-​3-​carboxaldehyde, 5-​chloro-
5-​Chloro-​1H-​pyrrolo[2,​3-​b]​pyridine-​3-​carboxaldehyde; 5-​Chloro-​7-​azaindole-​3-​carboxaldehyde 

Chemical Formula: C8H5ClN2O
Exact Mass: 180.01
Molecular Weight: 180.59
m/z: 180.01 (100.0%), 182.01 (32.2%), 181.01 (9.4%), 183.01 (2.8%)

InChI: InChI=1S/C8H5ClN2O/c9-6-1-7-5(4-12)2-10-8(7)11-3-6/h1-4H,(H,10,11)
InChIKey: NKTDCYOZPANZSE-UHFFFAOYSA-N
Canonical SMILES : C1=C2C(=CNC2=NC=C1Cl)C=O

Specification

98%

1. (1) Bahekar, Rajesh H.; Bioorganic & Medicinal Chemistry 2007, V15(21), P6782-6795 CAPLUS