CAS Registry Number:61727-33-1
Name:

5-chloro-2-(methylthio)pyrimidine-4-carboxylic acid

4-pyrimidinecarboxylic acid, 5-chloro-2-(methylthio)-

Chemical Formula: C6H5ClN2O2S
Exact Mass: 203.98
Molecular Weight: 204.63
m/z: 203.98 (100.0%), 205.97 (36.5%), 204.98 (7.4%), 206.98 (2.5%), 207.97 (1.5%)

InChI
InChI=1S/C6H5ClN2O2S/c1-12-6-8-2-3(7)4(9-6)5(10)11/h2H,1H3,(H,10,11)
InChI Key
SEPCYCDQJZTPHO-UHFFFAOYSA-N
Canonical SMILES
CSC1=NC=C(C(=N1)C(=O)O)Cl

Specification

98%

Synthetic Communications (2002), 32(1), 153-157