1H-1,3,5-benzotriazepine-2,4-diamine

Base Information

• Chemical Name: 1H-1,3,5-benzotriazepine-2,4-diamine
• CAS No.: 61911-80-6
• Molecular Formula: C8H9N5
• DSSTox Substance ID: DTXSID80392692

Synonyms:1H-1,3,5-benzotriazepine-2,4-diamine;61911-80-6;DTXSID80392692

Chemical Property of 1H-1,3,5-benzotriazepine-2,4-diamine

Chemical Property:

• XLogP3: 0.6
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 175.08579531
• Heavy Atom Count: 13
• Complexity: 257

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)NC(=NC(=N2)N)N

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