6,11-Dihydro-6-Methyl-11-(2-(1-Pyrrolidinyl)Ethoxy)-Dibenzo(c,f)(1,2)Thiazepine 5,5-Dioxide(Z)-2-Butenedioate (1:1)
[CAS# 155444-09-0]

Identification

• Name: 6,11-Dihydro-6-Methyl-11-(2-(1-Pyrrolidinyl)Ethoxy)-Dibenzo(c,f)(1,2)Thiazepine 5,5-Dioxide(Z)-2-Butenedioate (1:1)
• Molecular Formula: C₂₄H₂₈N₂O₇S
• Molecular Weight: 488.55
• CAS Registry Number: 155444-09-0
• SMILES: C4=C3[S](=O)(=O)N(C1=CC=CC=C1C(OCCN2CCCC2)C3=CC=C4)C.O=C(O)\C=C\C(=O)O
• InChI: 1S/C20H24N2O3S.C4H4O4/c1-21-18-10-4-2-8-16(18)20(25-15-14-22-12-6-7-13-22)17-9-3-5-11-19(17)26(21,23)24;5-3(6)1-2-4(7)8/h2-5,8-11,20H,6-7,12-15H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+
• InChIKey: JOPYULOJQGTWIS-WLHGVMLRSA-N

Properties

• Boiling point: 501.9°C at 760 mmHg (Cal.)
• Flash point: 257.3°C (Cal.)