3H-1,4-Benzodiazepine

Base Information

• Chemical Name: 3H-1,4-Benzodiazepine
• CAS No.: 264-65-3
• Molecular Formula: C9H8N2
• Molecular Weight: 144.17300
• DSSTox Substance ID: DTXSID40576299

Synonyms:3H-1,4-Benzodiazepine;264-65-3;SCHEMBL9728990;DTXSID40576299

Chemical Property of 3H-1,4-Benzodiazepine

Chemical Property:

• Boiling Point: 302.1±35.0 °C(Predicted)
• PSA: 24.72000
• Density: 1.11±0.1 g/cm3(Predicted)
• LogP: 0.69260
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 144.068748264
• Heavy Atom Count: 11
• Complexity: 184

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C=NC2=CC=CC=C2C=N1

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