2-(Methylthio)pyrimidine-4-carboxylic Acid - CAS 1126-44-9

Catalog: BB003009
Product Name: 2-(Methylthio)pyrimidine-4-carboxylic Acid
CAS: 1126-44-9
Synonyms: 2-(methylthio)-4-pyrimidinecarboxylic acid; 2-methylsulfanylpyrimidine-4-carboxylic acid
2-(Methylthio)pyrimidine-4-carboxylic Acid
IUPAC Name:2-methylsulfanylpyrimidine-4-carboxylic acid
Description:2-Thiomethylpyrimidine-4-carboxylic Acid was a useful reagent in development of orally bioavailable bicyclic pyrazolones as inhibitors of tumor necrosis factor.
Molecular Weight:170.19
Molecular Formula:C6H6N2O2S
Canonical SMILES:CSC1=NC=CC(=N1)C(=O)O
InChI:InChI=1S/C6H6N2O2S/c1-11-6-7-3-2-4(8-6)5(9)10/h2-3H,1H3,(H,9,10)
InChI Key:IAGNLKODEFUQDV-UHFFFAOYSA-N
Boiling Point:378.4 °C at 760 mmHg
Density:1.45 g/cm3
Storage:Keep in dark place, Inert atmosphere, Room temperature
MDL:MFCD09834808
LogP:0.89670

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