2-Chloro-11-[[2-(Dimethylamino)Ethyl]Methylamino]Dibenzo[b,f][1,4]Thiazepine
[CAS# 6550-57-8]

Identification

• Name: 2-Chloro-11-[[2-(Dimethylamino)Ethyl]Methylamino]Dibenzo[b,f][1,4]Thiazepine
• Synonyms: N-[(8-Chlorobenzo[B][1,5]Benzothiazepin-6-Yl)Methyl]-N',N'-Dimethyl-Ethane-1,2-Diamine; N-[(8-Chloro-6-Benzo[B][1,5]Benzothiazepinyl)Methyl]-N',N'-Dimethylethane-1,2-Diamine; (8-Chlorobenzo[B][1,5]Benzothiazepin-6-Yl)Methyl-(2-Dimethylaminoethyl)Amine
• Molecular Formula: C₁₈H₂₀ClN₃S
• Molecular Weight: 345.89
• CAS Registry Number: 6550-57-8
• SMILES: C1=C(Cl)C=CC2=C1C(=NC3=C(S2)C=CC=C3)CNCCN(C)C
• InChI: 1S/C18H20ClN3S/c1-22(2)10-9-20-12-16-14-11-13(19)7-8-17(14)23-18-6-4-3-5-15(18)21-16/h3-8,11,20H,9-10,12H2,1-2H3
• InChIKey: LGFFMPBXQOPBMN-UHFFFAOYSA-N

Properties

• Density: 1.239g/cm³ (Cal.)
• Boiling point: 460.67°C at 760 mmHg (Cal.)
• Flash point: 232.405°C (Cal.)