3'-Hydroxyhexobarbital
[CAS# 427-29-2]

Identification

• Name: 3'-Hydroxyhexobarbital
• Synonyms: 5-(3-Hydroxy-1-Cyclohexenyl)-1,5-Dimethyl-Hexahydropyrimidine-2,4,6-Trione; 5-(3-Hydroxy-1-Cyclohexenyl)-1,5-Dimethylhexahydropyrimidine-2,4,6-Trione; 5-(3-Hydroxy-1-Cyclohexenyl)-1,5-Dimethyl-Barbituric Acid
• Molecular Formula: C₁₂H₁₆N₂O₄
• Molecular Weight: 252.27
• CAS Registry Number: 427-29-2
• SMILES: CN1C(C(C(NC1=O)=O)(C2=CC(O)CCC2)C)=O
• InChI: 1S/C12H16N2O4/c1-12(7-4-3-5-8(15)6-7)9(16)13-11(18)14(2)10(12)17/h6,8,15H,3-5H2,1-2H3,(H,13,16,18)
• InChIKey: YHCGILGEMWNROZ-UHFFFAOYSA-N

Properties

• Density: 1.329g/cm³ (Cal.)