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5-Cyano-3,4-dihydro-2-methylthiopyrimidin-4-one
[CAS# 89487-99-0]

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Identification
Classification Pharmaceutical intermediate >> Heterocyclic compound intermediate >> Pyrimidine compound >> Thiopyrimidine
Name 5-Cyano-3,4-dihydro-2-methylthiopyrimidin-4-one
Synonyms 4-Hydroxy-2-[methylthio]pyrimidine-5-carbonitrile; 4-Hydroxy-2-methylsulfanylpyrimidine-5-carbonitrile
Molecular Structure CAS # 89487-99-0, 5-Cyano-3,4-dihydro-2-methylthiopyrimidin-4-one, 4-Hydroxy-2-[methylthio]pyrimidine-5-carbonitrile, 4-Hydroxy-2-methylsulfanylpyrimidine-5-carbonitrile
Molecular Formula C6H5N3OS
Molecular Weight 167.19
CAS Registry Number 89487-99-0
Properties
Solubility Very slightly soluble (0.97 g/L) (25 ºC), Calc.*
Density 1.42±0.1 g/cm3 (20 ºC 760 Torr), Calc.*
Melting point 222-224 ºC (isopropanol )**
* Calculated using Advanced Chemistry Development (ACD/Labs) Software V11.02 (©1994-2013 ACD/Labs)
** Gefenas, V.; Chemistry of Heterocyclic Compounds (New York, NY, United States) 2010, V46(3), P363-366.
Safety Data
SDS Available
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