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1,5,6,7-Tetrahydro-6-Thioxo-4H-Pyrazolo[3,4-d]Pyrimidin-4-One
[CAS# 24521-76-4]

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Identification
Classification Pharmaceutical intermediate >> Heterocyclic compound intermediate >> Pyrimidine compound >> Mercaptopyrimidine
Name 1,5,6,7-Tetrahydro-6-Thioxo-4H-Pyrazolo[3,4-d]Pyrimidin-4-One
Synonyms 6-Thioxo-1,2-Dihydropyrazolo[4,3-E]Pyrimidin-4-One; 6-Mercapto-1H-Pyrazolo[3,4-D]Pyrimidin-4-Ol; Nsc1391
Molecular Structure CAS#: 24521-76-4, 1,5,6,7-Tetrahydro-6-Thioxo-4H-Pyrazolo[3,4-d]Pyrimidin-4-One
Molecular Formula C5H4N4OS
Molecular Weight 168.17
CAS Registry Number 24521-76-4
EINECS 246-296-7
SMILES O=C1NC(=S)N=C2NNC=C12
InChI 1S/C5H4N4OS/c10-4-2-1-6-9-3(2)7-5(11)8-4/h1H,(H3,6,7,8,9,10,11)
InChIKey SXRSXYWROQWSGJ-UHFFFAOYSA-N
Properties
Density 1.8±0.1g/cm3 (Cal.)
Melting point 310°C (Expl.)
Boiling point 530.2±53.0°C at 760 mmHg (Cal.)
Flash point 274.5±30.9°C (Cal.)
Safety Data
Safety Description CAUTION: May irritate eyes, skin, and respiratory tract
SDS Available
Market Analysis Reports
List of Reports Available for 1,5,6,7-Tetrahydro-6-Thioxo-4H-Pyrazolo[3,4-d]Pyrimidin-4-One
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