6,11-Dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride

Base Information

• Chemical Name: 6,11-Dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride
• CAS No.: 82394-02-3
• Molecular Formula: C15H16ClNS
• Molecular Weight: 277.8122
• ChEMBL ID: CHEMBL1574821
• DSSTox Substance ID: DTXSID701002654
• Mol file: 82394-02-3.mol

Synonyms:82394-02-3;SMR000162796;MLS000538213;CHEMBL1574821;DTXSID701002654;6,11-dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride;1-(6,11-Dihydrodibenzo[b,e]thiepin-11-yl)methanamine--hydrogen chloride (1/1)

Chemical Property of 6,11-Dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride

Chemical Property:

• Vapor Pressure: 6.89E-06mmHg at 25°C
• Boiling Point: 377.2°Cat760mmHg
• Flash Point: 181.9°C
• PSA: 51.32000
• Density: g/cm³
• LogP: 4.88520
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 277.0691984
• Heavy Atom Count: 18
• Complexity: 255

Purity/Quality:

95% ^*data from raw suppliers

11-(AMINOMETHYL)-6,11-DIHYDRODIBENZO(B,E)THIEPIN HYDROCHLORIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C2=CC=CC=C2C(C3=CC=CC=C3S1)CN.Cl

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