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1,3-Dimethylbarbituric Acid

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1,3-Dimethylbarbituric acid / CAS : 769-42-6

Appearance Pale white crystal UN -
HS 29335400 DG Class -
Synonyms 6-Hydroxy-1,3-Dimethyluracil; Dimethylbarbituric acid; N,N'-Dimethyl-2,4,6-Pyrimidinetrione; 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1,3-Dimethyl-; 1,3-Dimethyl-1,3-Diazinane-2,4,6-Trione; N,N-Dimethylbarbituric acid; N,N'-Dimethylbarbituric acid; 1,3-Dimethyl-Pyrimidine-2,4,6-Trione; N',N-Dimethylbarbituric acid; NSC 61918; Barbituric acid, 1,3-Dimethyl- (6CI,7CI,8CI); 1,3-Dimethyl-2,4,6(1H,3H,5H)-Pyrimidinetrione; 1,3-Dimethyl-1,3-Diazacyclohexane-2,4,6-Trione
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Properties

Summary

Formula
C6H8N2O3
Molecular Mass
156.13900
Exact Mass
156.05300
PSA
57.69000
Logp
-0.69730
IUPAC
1,3-dimethyl-1,3-diazinane-2,4,6-trione
SMILES
CN1C(=O)CC(=O)N(C1=O)C

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Intermediates

Chemical and Physical Properties

Melting Point
121-123 °C
Density
1.322 g/cm3
Boiling Point
228.1ºC at 760 mmHg
Flash Point
95.3ºC
Appearance
Pale white crystal
Acidity and Basicity
alkalinity

Export information

HS Code
29335400
Export Rebate
13%
Risk Code
22-41
Safety Label
Xn

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