5,6,7,8,9,10-Hexahydro-4-phenyl-4H-(1)benzothieno(3,2-f)pyrrolo(1,2-a)(1,4)diazepine

Base Information

• Chemical Name: 5,6,7,8,9,10-Hexahydro-4-phenyl-4H-(1)benzothieno(3,2-f)pyrrolo(1,2-a)(1,4)diazepine
• CAS No.: 126684-57-9
• Molecular Formula: C20H20 N2 S
• Molecular Weight: 320.4512
• DSSTox Substance ID: DTXSID50925673
• Nikkaji Number: J629.267D
• Mol file: 126684-57-9.mol

Synonyms:5,6,7,8,9,10-Hexahydro-4-phenyl-4H-(1)benzothieno(3,2-f)pyrrolo(1,2-a)(1,4)diazepine;4H-(1)Benzothieno(3,2-f)pyrrolo(1,2-a)(1,4)diazepine, 5,6,7,8,9,10-hexahydro-4-phenyl-;126684-57-9;4-phenyl-5,6,7,8,9,10-hexahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine;DTXSID50925673;AKOS004911609;LS-41063;5,6-Dihydro-6-phenyl-2,3-butano-4H-pyrrolo[1,2-a]thieno[3,2-f][1,4]diazepine

Chemical Property of 5,6,7,8,9,10-Hexahydro-4-phenyl-4H-(1)benzothieno(3,2-f)pyrrolo(1,2-a)(1,4)diazepine

Chemical Property:

• Vapor Pressure: 9.06E-11mmHg at 25°C
• Boiling Point: 516.4°Cat760mmHg
• Flash Point: 266.1°C
• Density: 1.32g/cm³
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 320.13471982
• Heavy Atom Count: 23
• Complexity: 422

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC2=C(C1)C3=C(S2)N4C=CC=C4C(NC3)C5=CC=CC=C5

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