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4(3H)-Pyrimidinethione
[CAS# 133039-82-4]

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CAS#: 133039-82-4
Product: 4(3H)-Pyrimidinethione
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Identification
Classification Chemical reagent >> Organic reagent >> Thiol salt
Name 4(3H)-Pyrimidinethione
Synonyms 1,4-dihydropyrimidine-4-thione; 4(1H)-Pyrimidinethione; 4(1H)-Pyrimidinethione (9CI)
Molecular Structure CAS#: 133039-82-4, 4(3H)-Pyrimidinethione
Molecular Formula C4H4N2S
Molecular Weight 112.15
CAS Registry Number 133039-82-4
SMILES C1=CN=CNC1=S
InChI 1S/C4H4N2S/c7-4-1-2-5-3-6-4/h1-3H,(H,5,6,7)
InChIKey MGAXHFMCFLLMNG-UHFFFAOYSA-N
Properties
Density 1.3±0.1g/cm3 (Cal.)
Boiling point 191.3±23.0°C at 760 mmHg (Cal.)
Flash point 69.5±22.6°C (Cal.)
Refractive index 1.663 (Cal.)
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