Dimethylphenobarbital
[CAS# 730-66-5]

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 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.)