1,3,7-Trimethyl-8-[2-[(E)-(6-Oxo-1-Cyclohexa-2,4-Dienylidene)Methyl]Hydrazinyl]Purine-2,6-Dione
[CAS# 6306-69-0]

Identification

• Name: 1,3,7-Trimethyl-8-[2-[(E)-(6-Oxo-1-Cyclohexa-2,4-Dienylidene)Methyl]Hydrazinyl]Purine-2,6-Dione
• Synonyms: 1,3,7-Trimethyl-8-[N'-[(E)-(6-Oxo-1-Cyclohexa-2,4-Dienylidene)Methyl]Hydrazino]Purine-2,6-Dione; 8-[N'-[(E)-(6-Keto-1-Cyclohexa-2,4-Dienylidene)Methyl]Hydrazino]-1,3,7-Trimethyl-Xanthine; Nsc42042
• Molecular Formula: C₁₅H₁₆N₆O₃
• Molecular Weight: 328.33
• CAS Registry Number: 6306-69-0
• SMILES: C[N]2C1=C(N(C(=O)N(C1=O)C)C)N=C2NN\C=C3\C(=O)C=CC=C3
• InChI: 1S/C15H16N6O3/c1-19-11-12(20(2)15(24)21(3)13(11)23)17-14(19)18-16-8-9-6-4-5-7-10(9)22/h4-8,16H,1-3H3,(H,17,18)/b9-8+
• InChIKey: CGJNAJFDWQCFRE-CMDGGOBGSA-N

Properties

• Density: 1.464g/cm³ (Cal.)
• Boiling point: 570.267°C at 760 mmHg (Cal.)
• Flash point: 298.687°C (Cal.)