2-{2-[(E)-{[4-(8-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl)-1-piperazinyl]imino}methyl]phenoxy}-N,N-dimethylethanamine hydrochloride (1:1)
[CAS# 86759-06-0]

Identification

• Name: 2-{2-[(E)-{[4-(8-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl)-1-piperazinyl]imino}methyl]phenoxy}-N,N-dimethylethanamine hydrochloride (1:1)
• Molecular Formula: C₂₉H₃₄Cl₂N₄OS
• Molecular Weight: 557.58
• CAS Registry Number: 86759-06-0
• SMILES: Cl.Clc5cc2c(Sc1ccccc1CC2N4CCN(/N=C/c3ccccc3OCCN(C)C)CC4)cc5
• InChI: 1S/C29H33ClN4OS.ClH/c1-32(2)17-18-35-27-9-5-3-8-23(27)21-31-34-15-13-33(14-16-34)26-19-22-7-4-6-10-28(22)36-29-12-11-24(30)20-25(26)29;/h3-12,20-21,26H,13-19H2,1-2H3;1H/b31-21+
• InChIKey: ZTUGGHDHTCTDPY-GEQVRVAYSA-N

Properties

• Boiling point: 643.7°C at 760 mmHg (Cal.)
• Flash point: 343.1°C (Cal.)