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CAS Number: 46118-95-0
2-((4-methylpyrimidin-2-yl)thio)acetic acid

Structure

2-((4-methylpyrimidin-2-yl)thio)acetic acid
Name: 2-((4-methylpyrimidin-2-yl)thio)acetic acid
Synonyms:
General Information
Product Number: 46118950

CAS Registry Number 46118-95-0
Name:
Acetic acid, 2-​[(4-​methyl-​2-​pyrimidinyl)​thio]​-
Acetic acid, [(4-methyl-2-pyrimidinyl)thio]- (6CI,9CI)
2-(Carboxymethylthio)-4-methylpyrimidine
2-[(4-Methylpyrimidin-2-yl)thio]acetic acid
NSC 164942
[(4-Methyl-2-pyrimidinyl)sulfanyl]acetic acid

 

Chemical Formula: C7H8N2O2S
Exact Mass: 184.03
Molecular Weight: 184.22
m/z: 184.03 (100.0%), 185.03 (9.2%), 186.03 (5.1%)

 

InChI:InChI=1S/C7H8N2O2S/c1-5-2-3-8-7(9-5)12-4-6(10)11/h2-3H,4H2,1H3,(H,10,11)

InChI Key:CGMJQRAIQBSTCC-UHFFFAOYSA-N

Canonical SMILES:CC1=NC(=NC=C1)SCC(=O)O

 

Thermal Properties Value Condition Note
Melting Point 191 °C Solv: water (7732-18-5) (3)CAS

Specification

98%

References
  1. (3) Hunt, R. R.; Journal of the Chemical Society 1959, P525-30 CAPLUS
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