11-(Methylaminomethyl)-6,11-Dihydrodibenzo(b,e)Thiepin Hydrochloride
[CAS# 82394-08-9]

Identification

• Name: 11-(Methylaminomethyl)-6,11-Dihydrodibenzo(b,e)Thiepin Hydrochloride
• Synonyms: 6,11-Dihydrobenzo[C][1]Benzothiepin-11-Ylmethyl-Methyl-Ammonium Chloride; 6,11-Dihydrobenzo[C][1]Benzothiepin-11-Ylmethyl-Methylammonium Chloride; 6,11-Dihydrobenzo[C][1]Benzothiepin-11-Ylmethyl-Methyl-Azanium Chloride
• Molecular Formula: C₁₆H₁₈ClNS
• Molecular Weight: 291.84
• CAS Registry Number: 82394-08-9
• SMILES: C1=CC=CC2=C1C(C3=C(CS2)C=CC=C3)C[NH2+]C.[Cl-]
• InChI: 1S/C16H17NS.ClH/c1-17-10-15-13-7-3-2-6-12(13)11-18-16-9-5-4-8-14(15)16;/h2-9,15,17H,10-11H2,1H3;1H
• InChIKey: QYVJZJBUIBZARG-UHFFFAOYSA-N

Properties

• Boiling point: 373.5°C at 760 mmHg (Cal.)
• Flash point: 179.7°C (Cal.)