CAS Registry Number: 10517-21-2
Name:

5-chloro-1H-indole-2-carboxylic acid

5-Chloroindole-2-carboxylic acid

Chemical Formula: C9H6ClNO2
Exact Mass: 195.01
Molecular Weight: 195.60
m/z: 195.01 (100.0%), 197.01 (32.4%), 196.01 (10.2%), 198.01 (3.2%)

InChI
InChI=1S/C9H6ClNO2/c10-6-1-2-7-5(3-6)4-8(11-7)9(12)13/h1-4,11H,(H,12,13)
InChI Key
FUQOTYRCMBZFOL-UHFFFAOYSA-N
Canonical SMILES
C1=CC2=C(C=C1Cl)C=C(N2)C(=O)O

Specification

98%

ChemMedChem (2018), 13(12), 1181-1192.

Chemical Biology & Drug Design (2017), 90(1), 64-82