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CAS Number: 87600-98-4
4,6-dichloropyrimidine-5-carboxylic acid

Structure

4,6-dichloropyrimidine-5-carboxylic acid
Name: 4,6-dichloropyrimidine-5-carboxylic acid
Synonyms:
General Information
Product Number: 87600984

CAS Registry Number 87600-98-4
Name:
5-​Pyrimidinecarboxylic acid, 4,​6-​dichloro-
4,6-Dichloro-5-pyrimidinecarboxylic acid

 

Chemical Formula: C5H2Cl2N2O2
Exact Mass: 191.95
Molecular Weight: 192.99
m/z: 191.95 (100.0%), 193.95 (64.4%), 195.94 (10.2%), 192.95 (6.2%), 194.95 (3.5%)

 

InChI:InChI=1S/C5H2Cl2N2O2/c6-3-2(5(10)11)4(7)9-1-8-3/h1H,(H,10,11)

InChI Key:KGBLYFGHJNGQBK-UHFFFAOYSA-N

Canonical SMILES:C1=NC(=C(C(=N1)Cl)C(=O)O)Cl

Specification

98%

References
  1. (1) Seto, Shigeki; Journal of Medicinal Chemistry 2010, V53(13), P5012-5024 CAPLUS
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