Dihydro-5-(1-methylpropyl)-5-(2-propen-1-yl)-2-thioxo-4,6(1H,5H)-pyrimidinedione
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Dihydro-5-(1-methylpropyl)-5-(2-propen-1-yl)-2-thioxo-4,6(1H,5H)-pyrimidinedione
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CAS No:
2095-58-1
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Formula:
C11H16N2O2S
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Chemical Name:
Dihydro-5-(1-methylpropyl)-5-(2-propen-1-yl)-2-thioxo-4,6(1H,5H)-pyrimidinedione
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Synonyms:
4,6(1H,5H)-Pyrimidinedione,dihydro-5-(1-methylpropyl)-5-(2-propen-1-yl)-2-thioxo-;Barbituric acid,5-allyl-5-sec-butyl-2-thio-;4,6(1H,5H)-Pyrimidinedione,dihydro-5-(1-methylpropyl)-5-(2-propenyl)-2-thioxo-;Dihydro-5-(1-methylpropyl)-5-(2-propen-1-yl)-2-thioxo-4,6(1H,5H)-pyrimidinedione
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CAS No:
Dihydro-5-(1-methylpropyl)-5-(2-propen-1-yl)-2-thioxo-4,6(1H,5H)-pyrimidinedione Basic Attributes
67.8062096
240.32
2933599090
Characteristics
97.27000
1.67770
1.18g/cm3
142-143 °C
1.557
Intravenous-mouse LD50: 150 mg/kg; oral-rabbit LDL0: 500 mg/kg
Flammable; burning produces toxic nitrogen oxides, sulfur oxide fumes
Safety Information
Treasury is ventilated, low temperature and dry; stored separately from food materials
Computed Properties
Molecular Weight:240.32
XLogP3:2.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:240.09324893
Monoisotopic Mass:240.09324893
Topological Polar Surface Area:90.3
Heavy Atom Count:16
Complexity:332
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Dihydro-5-(1-methylpropyl)-5-(2-propen-1-yl)-2-thioxo-4,6(1H,5H)-pyrimidinedione
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