1-Cyclohexyl-5-Ethyl-3-Phenyl-1,3-Diazinane-2,4,6-Trione
[CAS# 1042-85-9]

Identification

• Name: 1-Cyclohexyl-5-Ethyl-3-Phenyl-1,3-Diazinane-2,4,6-Trione
• Synonyms: 1-Cyclohexyl-5-Ethyl-3-Phenyl-Hexahydropyrimidine-2,4,6-Trione; 1-Cyclohexyl-5-Ethyl-3-Phenylhexahydropyrimidine-2,4,6-Trione; 1-Cyclohexyl-5-Ethyl-3-Phenyl-Barbituric Acid
• Molecular Formula: C₁₈H₂₂N₂O₃
• Molecular Weight: 314.38
• CAS Registry Number: 1042-85-9
• SMILES: C1=CC=CC=C1N3C(N(C2CCCCC2)C(C(C3=O)CC)=O)=O
• InChI: 1S/C18H22N2O3/c1-2-15-16(21)19(13-9-5-3-6-10-13)18(23)20(17(15)22)14-11-7-4-8-12-14/h3,5-6,9-10,14-15H,2,4,7-8,11-12H2,1H3
• InChIKey: VHGLHDSRPPOBQD-UHFFFAOYSA-N

Properties

• Density: 1.209g/cm³ (Cal.)
• Boiling point: 434.936°C at 760 mmHg (Cal.)
• Flash point: 181.005°C (Cal.)