9-(2-Chloro-6-Fluorobenzyl)-6-Dimethylaminopurine
[CAS# 70091-23-5]

Identification

• Name: 9-(2-Chloro-6-Fluorobenzyl)-6-Dimethylaminopurine
• Synonyms: 9-[(2-Chloro-6-Fluoro-Phenyl)Methyl]-N,N-Dimethyl-Purin-6-Amine; 9-[(2-Chloro-6-Fluorophenyl)Methyl]-N,N-Dimethyl-6-Purinamine; [9-(2-Chloro-6-Fluoro-Benzyl)Purin-6-Yl]-Dimethyl-Amine
• Molecular Formula: C₁₄H₁₃ClFN₅
• Molecular Weight: 305.74
• CAS Registry Number: 70091-23-5
• SMILES: C1=NC3=C([N]1CC2=C(C=CC=C2Cl)F)N=CN=C3N(C)C
• InChI: 1S/C14H13ClFN5/c1-20(2)13-12-14(18-7-17-13)21(8-19-12)6-9-10(15)4-3-5-11(9)16/h3-5,7-8H,6H2,1-2H3
• InChIKey: ZRTHYLLRNKJAEG-UHFFFAOYSA-N

Properties

• Density: 1.398g/cm³ (Cal.)
• Boiling point: 474.982°C at 760 mmHg (Cal.)
• Flash point: 241.061°C (Cal.)