2-(4-Allyl-1-piperazinyl)-4-butoxyquinazoline fumarate (2:3)
[CAS# 129663-99-6]

Identification

• Name: 2-(4-Allyl-1-piperazinyl)-4-butoxyquinazoline fumarate (2:3)
• Synonyms: 2-(4-Allylpiperazin-1-Yl)-4-Butoxy-Quinazoline; 2-(4-Allylpiperazin-1-Yl)-4-Butoxy-Quinazoline; But-2-Enedioic Acid; 2-(4-Allyl-1-Piperazinyl)-4-Butoxyquinazoline; 2-(4-Allyl-1-Piperazinyl)-4-Butoxyquinazoline; But-2-Enedioic Acid
• Molecular Formula: C₅₀H₆₄N₈O₁₄
• Molecular Weight: 1001.10
• CAS Registry Number: 129663-99-6
• SMILES: C1=CC=CC2=NC(=NC(=C12)OCCCC)N3CCN(CC3)CC=C.C4=CC=CC5=NC(=NC(=C45)OCCCC)N6CCN(CC6)CC=C.O=C(O)\C=C\C(=O)O.O=C(O)\C=C\C(=O)O.O=C(O)\C=C\C(=O)O
• InChI: 1S/2C19H26N4O.3C4H4O4/c2*1-3-5-15-24-18-16-8-6-7-9-17(16)20-19(21-18)23-13-11-22(10-4-2)12-14-23;3*5-3(6)1-2-4(7)8/h2*4,6-9H,2-3,5,10-15H2,1H3;3*1-2H,(H,5,6)(H,7,8)/b;;3*2-1+
• InChIKey: WLAFFPDQVAFIOY-VQYXCCSOSA-N

Properties

• Boiling point: 486.4°C at 760 mmHg (Cal.)
• Flash point: 248°C (Cal.)