6-Mercapto-4(1H)-pyrimidinone
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6-Mercapto-4(1H)-pyrimidinone
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CAS No:
6311-83-7
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Formula:
C4H4N2OS
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Chemical Name:
6-Mercapto-4(1H)-pyrimidinone
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Synonyms:
6-mercaptopyrimidin-4(1H)-one;6-MERCAPTO-4(1H)-PYRIMIDINONE;4(1H)-Pyrimidinone, 6-mercapto;4(1H)-Pyrimidinone, 6-mercapto- (9CI)
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CAS No:
Characteristics
42.5
-0.54
1.5±0.1 g/cm3
247 °C(Solv: water (7732-18-5))
231.9±50.0 °C at 760 mmHg
94.0±30.1 °C
1.713
Computed Properties
Molecular Weight:128.15
XLogP3:-0.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Exact Mass:128.00443393
Monoisotopic Mass:128.00443393
Topological Polar Surface Area:42.5
Heavy Atom Count:8
Complexity:173
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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