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Dimethylphenobarbital
[CAS# 730-66-5]

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Identification
Name Dimethylphenobarbital
Synonyms 5-Ethyl-1,3-Dimethyl-5-Phenyl-Hexahydropyrimidine-2,4,6-Trione; 5-Ethyl-1,3-Dimethyl-5-Phenylhexahydropyrimidine-2,4,6-Trione; 5-Ethyl-1,3-Dimethyl-5-Phenyl-Barbituric Acid
Molecular Structure CAS#: 730-66-5, Dimethylphenobarbital
Molecular Formula C14H16N2O3
Molecular Weight 260.29
CAS Registry Number 730-66-5
SMILES C2=C(C1(C(N(C(=O)N(C1=O)C)C)=O)CC)C=CC=C2
InChI 1S/C14H16N2O3/c1-4-14(10-8-6-5-7-9-10)11(17)15(2)13(19)16(3)12(14)18/h5-9H,4H2,1-3H3
InChIKey RPJARFKGODFVHL-UHFFFAOYSA-N
Properties
Density 1.193g/cm3 (Cal.)
Boiling point 366.776°C at 760 mmHg (Cal.)
Flash point 153.245°C (Cal.)
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