8-(1-Cyclohex-3-Enyl)-1,3-Dimethyl-7H-Purine-2,6-Dione
[CAS# 74039-68-2]

Identification

• Name: 8-(1-Cyclohex-3-Enyl)-1,3-Dimethyl-7H-Purine-2,6-Dione
• Synonyms: 8-(1-Cyclohex-3-Enyl)-1,3-Dimethyl-7H-Purine-2,6-Quinone; Nsc 106214; 1H-Purine-2,6-Dione, 8-(3-Cyclohexen-1-Yl)-3,7-Dihydro-1,3-Dimethyl-
• Molecular Formula: C₁₃H₁₆N₄O₂
• Molecular Weight: 260.30
• CAS Registry Number: 74039-68-2
• SMILES: CN1C2=C(C(N(C1=O)C)=O)[NH]C(=N2)C3CC=CCC3
• InChI: 1S/C13H16N4O2/c1-16-11-9(12(18)17(2)13(16)19)14-10(15-11)8-6-4-3-5-7-8/h3-4,8H,5-7H2,1-2H3,(H,14,15)
• InChIKey: VUVQIGQQUJUTRY-UHFFFAOYSA-N

Properties

• Density: 1.319g/cm³ (Cal.)
• Boiling point: 523.957°C at 760 mmHg (Cal.)
• Flash point: 270.68°C (Cal.)