Eptapirone
[CAS# 179756-85-5]

Identification

• Name: Eptapirone
• Synonyms: 4-Methyl-2-[4-[4-(2-Pyrimidinyl)-1-Piperazinyl]Butyl]-1,2,4-Triazine-3,5-Dione; 4-Methyl-2-[4-(4-Pyrimidin-2-Ylpiperazin-1-Yl)Butyl]-1,2,4-Triazine-3,5-Quinone; D02576
• Molecular Formula: C₁₆H₂₃N₇O₂
• Molecular Weight: 345.40
• CAS Registry Number: 179756-85-5
• SMILES: C1=CC=NC(=N1)N2CCN(CC2)CCCCN3N=CC(=O)N(C3=O)C
• InChI: 1S/C16H23N7O2/c1-20-14(24)13-19-23(16(20)25)8-3-2-7-21-9-11-22(12-10-21)15-17-5-4-6-18-15/h4-6,13H,2-3,7-12H2,1H3
• InChIKey: NMYAHEULKSYAPP-UHFFFAOYSA-N

Properties

• Density: 1.351g/cm³ (Cal.)
• Boiling point: 517.385°C at 760 mmHg (Cal.)
• Flash point: 266.705°C (Cal.)