Phenyl 4-nitro-N-(4-nitrophenyl)benzene-1-carbohydrazonate
Basic information
- CAS
5204-83-1- Standard SMILES
O=[N+]([O-])c1ccc(NN=C(Oc2ccccc2)c2ccc([N+](=O)[O-])cc2)cc1- InChIKey
LHUCNCYAUXHOJD-UHFFFAOYSA-N- Molecular formula
- C19H14N4O5
- Average molar mass
- 378.3 g/mol
- Monoisotopic mass
- 378.09641956
Names & identifiers
- Preferred name
- Phenyl 4-nitro-N-(4-nitrophenyl)benzene-1-carbohydrazonate
- IUPAC
- phenyl 4-nitro-N-(4-nitrophenyl)benzenecarbohydrazonate
Names & synonyms
5204-83-1MLS003115228CHEMBL1897291DTXSID80966397Phenyl 4-nitro-N-(4-nitrophenyl)benzene-1-carbohydrazonateSMR001830810
Database identifiers
- CAS
5204-83-1- PubChem CID
- 315531
- DTXSID
DTXSID80966397- ChEMBL
CHEMBL1897291
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 125 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 552
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Compound notes
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