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CAS Number: 97229-11-3
4-chloro-2-(methylsulfonyl)pyrimidine

Structure

 4-chloro-2-(methylsulfonyl)pyrimidine
Name: 4-chloro-2-(methylsulfonyl)pyrimidine
Synonyms:
General Information
Product Number: 97229113

CAS Registry Number 97229-11-3
Name:
Pyrimidine, 4-?chloro-?2-?(methylsulfonyl)?-
4-Chloro-2-(methylsulfonyl)pyrimidine

 

Chemical Formula: C5H5ClN2O2S
Exact Mass: 191.98
Molecular Weight: 192.62
m/z: 191.98 (100.0%), 193.97 (36.5%), 192.98 (6.3%), 194.98 (2.1%), 195.97 (1.5%)

 

InChI:InChI=1S/C5H5ClN2O2S/c1-11(9,10)5-7-3-2-4(6)8-5/h2-3H,1H3

InChI Key:BWVZLXTZQHILRC-UHFFFAOYSA-N

Canonical SMILES:CS(=O)(=O)C1=NC=CC(=N1)Cl

 

Thermal Properties Value Condition Note
Melting Point 88-89 °C   (1)CAS
Melting Point 87-89 °C Solv: ethyl ether (60-29-7) (2)IC

Specification

98%
References
  1. (1) Serrano, Catherine M.; Organic Letters 2011, V13(19), P5000-5003 CAPLUS
  2. (2) Hurst, Derek T.; Heterocycles 1985, V23(3), P611-16 CAPLUS
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