1-(10,11-Dihydro-3,7-Dimethoxydibenzo(b,f)Thiepin-10-Yl)-4-Methylpiperazine Maleate
[CAS# 80709-63-3]

Identification

• Name: 1-(10,11-Dihydro-3,7-Dimethoxydibenzo(b,f)Thiepin-10-Yl)-4-Methylpiperazine Maleate
• Synonyms: But-2-Enedioic Acid; 1-(2,9-Dimethoxy-5,6-Dihydrobenzo[B][1]Benzothiepin-6-Yl)-4-Methyl-Piperazine; 1-(10,11-Dihydro-3,7-Dimethoxydibenzo(B,F)Thiepin-10-Yl)-4-Methylpiperazine Maleate; 3,7-Dimethoxy-10-(4-Methylpiperazino)-10,11-Dihydrodibenzo(B,F)Thiepin Maleate
• Molecular Formula: C₂₅H₃₀N₂O₆S
• Molecular Weight: 486.58
• CAS Registry Number: 80709-63-3
• SMILES: C4=C3C(N1CCN(CC1)C)CC2=CC=C(OC)C=C2SC3=CC(=C4)OC.O=C(O)\C=C\C(=O)O
• InChI: 1S/C21H26N2O2S.C4H4O4/c1-22-8-10-23(11-9-22)19-12-15-4-5-16(24-2)13-20(15)26-21-14-17(25-3)6-7-18(19)21;5-3(6)1-2-4(7)8/h4-7,13-14,19H,8-12H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1+
• InChIKey: LQUMAVLNXCTQQV-WLHGVMLRSA-N

Properties

• Boiling point: 482.1°C at 760 mmHg (Cal.)
• Flash point: 245.4°C (Cal.)