5-(M-Trifluoromethoxybenzyl)-2,4-Pyrimidinediamine
[CAS# 50823-99-9]

Identification

• Name: 5-(M-Trifluoromethoxybenzyl)-2,4-Pyrimidinediamine
• Synonyms: [2-Amino-5-[3-(Trifluoromethoxy)Benzyl]Pyrimidin-4-Yl]Amine; Pyrimidine, 2,4-Diamino-5-(M-(Trifluoromethoxy)Benzyl)-; 2,4-Diamino-5-(M-(Trifluoromethoxy)Benzyl)Pyrimidine
• Molecular Formula: C₁₂H₁₁F₃N₄O
• Molecular Weight: 284.24
• CAS Registry Number: 50823-99-9
• SMILES: C1=C(OC(F)(F)F)C=CC=C1CC2=CN=C(N=C2N)N
• InChI: 1S/C12H11F3N4O/c13-12(14,15)20-9-3-1-2-7(5-9)4-8-6-18-11(17)19-10(8)16/h1-3,5-6H,4H2,(H4,16,17,18,19)
• InChIKey: MORSQLMVFPANHY-UHFFFAOYSA-N

Properties

• Density: 1.42g/cm³ (Cal.)
• Boiling point: 443.45°C at 760 mmHg (Cal.)
• Flash point: 221.991°C (Cal.)