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4-Oxo-2-Thioxo-1,2,3,4-Tetrahydro-5-Pyrimidinecarbonitrile
[CAS# 23945-49-5]

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Identification
Name 4-Oxo-2-Thioxo-1,2,3,4-Tetrahydro-5-Pyrimidinecarbonitrile
Synonyms 2-Mercapto-4-hydroxy-5-cyanopyrimidine; 4-Hydroxy-2-mercapto-pyrimidine-5-carbonitrile; 4-hydroxy-2-sulfanylpyrimidine-5-carbonitrile
Molecular Structure CAS#: 23945-49-5, 4-Oxo-2-Thioxo-1,2,3,4-Tetrahydro-5-Pyrimidinecarbonitrile
Molecular Formula C5H3N3OS
Molecular Weight 153.16
CAS Registry Number 23945-49-5
SMILES O=C1C(\C#N)=C/NC(=S)N1
InChI 1S/C5H3N3OS/c6-1-3-2-7-5(10)8-4(3)9/h2H,(H2,7,8,9,10)
InChIKey XIRKMYIHJOEYDQ-UHFFFAOYSA-N
Properties
Density 1.564g/cm3 (Cal.)
Boiling point 422.8°C at 760 mmHg (Cal.)
Flash point 209.5°C (Cal.)
Refractive index 1.687 (Cal.)
Safety Data
SDS Available
Market Analysis Reports
List of Reports Available for 4-Oxo-2-Thioxo-1,2,3,4-Tetrahydro-5-Pyrimidinecarbonitrile
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