4-[(E)-{[4-(10,11-Dihydrodibenzo[b,f]thiepin-10-yl)-1-piperazinyl]imino}methyl]-N,N-dimethylaniline
[CAS# 86758-95-4]

Identification

• Name: 4-[(E)-{[4-(10,11-Dihydrodibenzo[b,f]thiepin-10-yl)-1-piperazinyl]imino}methyl]-N,N-dimethylaniline
• Synonyms: 1-Piperazinamine, 4-(10,11-dihydrodibenzo(b,f)thiepin-10-yl)-N-((4-(dimethylamino)phenyl)methylene)-; BRN 4595775
• Molecular Formula: C₂₇H₃₀N₄S
• Molecular Weight: 442.62
• CAS Registry Number: 86758-95-4
• SMILES: N(=C/c1ccc(N(C)C)cc1)\N5CCN(C3c4c(Sc2ccccc2C3)cccc4)CC5
• InChI: 1S/C27H30N4S/c1-29(2)23-13-11-21(12-14-23)20-28-31-17-15-30(16-18-31)25-19-22-7-3-5-9-26(22)32-27-10-6-4-8-24(25)27/h3-14,20,25H,15-19H2,1-2H3/b28-20+
• InChIKey: BFXFWBVVOHPTLH-VFCFBJKWSA-N

Properties

• Density: 1.183g/cm³ (Cal.)
• Boiling point: 595.156°C at 760 mmHg (Cal.)
• Flash point: 313.739°C (Cal.)