6,11-Dihydro-6-Methyl-11-(2-(1-Piperazinyl)Ethoxy)-Dibenzo(c,f)(1,2)Thiazepine 5,5-Dioxide (Z)-2-Butenedioate (1:1)
[CAS# 155444-13-6]

Identification

• Name: 6,11-Dihydro-6-Methyl-11-(2-(1-Piperazinyl)Ethoxy)-Dibenzo(c,f)(1,2)Thiazepine 5,5-Dioxide (Z)-2-Butenedioate (1:1)
• Molecular Formula: C₂₈H₃₃N₃O₁₁S
• Molecular Weight: 619.64
• CAS Registry Number: 155444-13-6
• SMILES: C4=C3[S](=O)(=O)N(C1=CC=CC=C1C(OCCN2CCNCC2)C3=CC=C4)C.O=C(O)\C=C\C(=O)O.O=C(O)\C=C\C(=O)O
• InChI: 1S/C20H25N3O3S.2C4H4O4/c1-22-18-8-4-2-6-16(18)20(26-15-14-23-12-10-21-11-13-23)17-7-3-5-9-19(17)27(22,24)25;2*5-3(6)1-2-4(7)8/h2-9,20-21H,10-15H2,1H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1+
• InChIKey: FOTPXIFZQCBAQM-LVEZLNDCSA-N

Properties

• Boiling point: 536.5°C at 760 mmHg (Cal.)
• Flash point: 278.3°C (Cal.)