2-[(3,4-Dichlorophenyl)Methylamino]-3,7-Dihydropurin-6-One
[CAS# 133338-58-6]

Identification

• Name: 2-[(3,4-Dichlorophenyl)Methylamino]-3,7-Dihydropurin-6-One
• Synonyms: 2-[(3,4-Dichlorobenzyl)Amino]-3,7-Dihydropurin-6-One; 6H-Purin-6-One, 2-(((3,4-Dichlorophenyl)Methyl)Amino)-1,7-Dihydro-; Dcbg
• Molecular Formula: C₁₂H₉Cl₂N₅O
• Molecular Weight: 310.14
• CAS Registry Number: 133338-58-6
• SMILES: C3=C(CNC1=NC(=O)C2=C(N1)N=C[NH]2)C=CC(=C3Cl)Cl
• InChI: 1S/C12H9Cl2N5O/c13-7-2-1-6(3-8(7)14)4-15-12-18-10-9(11(20)19-12)16-5-17-10/h1-3,5H,4H2,(H3,15,16,17,18,19,20)
• InChIKey: JSCNOJMNXGDROK-UHFFFAOYSA-N

Properties

• Density: 1.725g/cm³ (Cal.)
• Boiling point: 602.806°C at 760 mmHg (Cal.)
• Flash point: 318.366°C (Cal.)