8-[(2-Chlorophenyl)Amino]-3,7-Dihydro-1,3-Dimethyl-1H-Purine-2,6-Dione
[CAS# 5429-34-5]

Identification

• Name: 8-[(2-Chlorophenyl)Amino]-3,7-Dihydro-1,3-Dimethyl-1H-Purine-2,6-Dione
• Synonyms: 8-[(2-Chlorophenyl)Amino]-1,3-Dimethyl-7H-Purine-2,6-Quinone; 1H-Purine-2,6-Dione, 8-[(2-Chlorophenyl)Amino]-3,7-Dihydro-1,3-Dimethyl-; 1H-Purine-2,6-Dione, 8-((2-Chlorophenyl)Amino)-3,7-Dihydro-1,3-Dimethyl- (9Ci)
• Molecular Formula: C₁₃H₁₂ClN₅O₂
• Molecular Weight: 305.72
• CAS Registry Number: 5429-34-5
• SMILES: C3=C(NC1=NC2=C([NH]1)C(N(C)C(N2C)=O)=O)C(=CC=C3)Cl
• InChI: 1S/C13H12ClN5O2/c1-18-10-9(11(20)19(2)13(18)21)16-12(17-10)15-8-6-4-3-5-7(8)14/h3-6H,1-2H3,(H2,15,16,17)
• InChIKey: WNYQXOIYVOXWAJ-UHFFFAOYSA-N

Properties

• Density: 1.522g/cm³ (Cal.)
• Boiling point: 532.437°C at 760 mmHg (Cal.)
• Flash point: 275.808°C (Cal.)