3-Dibenzo[b,e]Thiepin-11(6H)-Ylidene-8-Methyl-8-Azabicyclo[3.2.1]Octane Hydrochloride
[CAS# 27574-25-0]

Identification

• Name: 3-Dibenzo[b,e]Thiepin-11(6H)-Ylidene-8-Methyl-8-Azabicyclo[3.2.1]Octane Hydrochloride
• Synonyms: 1-Alpha-H,5-Alpha-H-Tropane, 3-Dibenzo(B,E)Thiepin-11(6H)-Ylidene-, Hydrochloride; 3-Dibenzo(B,E)Thiepin-11(6H)-Ylidene-8-Methyl-8-Azabicyclo(3.2.1)Octane Hydrochloride; 3-Dibenzo(B,E)Thiepin-11(6H)-Ylidenetropane Hydrochloride
• Molecular Formula: C₂₂H₂₄ClNS
• Molecular Weight: 369.95
• CAS Registry Number: 27574-25-0
• EINECS: 248-535-0
• SMILES: [H+].C5=C4\C(=C1\CC2N(C(C1)CC2)C)C3=CC=CC=C3CSC4=CC=C5.[Cl-]
• InChI: 1S/C22H23NS.ClH/c1-23-17-10-11-18(23)13-16(12-17)22-19-7-3-2-6-15(19)14-24-21-9-5-4-8-20(21)22;/h2-9,17-18H,10-14H2,1H3;1H
• InChIKey: LVASURLUIYTDHW-UHFFFAOYSA-N

Properties

• Boiling point: 493.1°C at 760 mmHg (Cal.)
• Flash point: 252°C (Cal.)