Benzenamine, 4-nitro-N-[(3-nitrophenyl)methylene]-
Basic information
- CAS
17064-97-0- Standard SMILES
O=[N+]([O-])c1ccc(N=Cc2cccc([N+](=O)[O-])c2)cc1- InChIKey
LJNJGJDGCKTTEG-UHFFFAOYSA-N- Molecular formula
- C13H9N3O4
- Average molar mass
- 271.23 g/mol
- Monoisotopic mass
- 271.05930578
Names & identifiers
- Preferred name
- Benzenamine, 4-nitro-N-[(3-nitrophenyl)methylene]-
- IUPAC
- 1-(3-nitrophenyl)-N-(4-nitrophenyl)methanimine
Names & synonyms
Benzenamine, 4-nitro-N-[(3-nitrophenyl)methylene]-DTXSID20394872AKOS02746160817064-97-0(E)-1-(3-Nitrophenyl)-N-(4-nitrophenyl)methanimine
Database identifiers
- CAS
17064-97-0- PubChem CID
- 3671384
- DTXSID
DTXSID20394872
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 380
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Compound notes
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