N-(3,5-dinitrophenyl)-3,5-dinitrobenzamide
Basic information
- CAS
58338-55-9- Standard SMILES
O=C(Nc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1- InChIKey
MDVCUXQIKDIHNJ-UHFFFAOYSA-N- Molecular formula
- C13H7N5O9
- Average molar mass
- 377.22 g/mol
- Monoisotopic mass
- 377.02437682
Names & identifiers
- Preferred name
- N-(3,5-dinitrophenyl)-3,5-dinitrobenzamide
- IUPAC
- N-(3,5-dinitrophenyl)-3,5-dinitrobenzamide
Names & synonyms
N-(3,5-dinitrophenyl)-3,5-dinitrobenzamide58338-55-9DTXSID50305638RefChem:361136DTXCID60256768NSC171310N-(3,5-Dinitro-phenyl)-3,5-dinitro-benzamideSCHEMBL9167111MDVCUXQIKDIHNJ-UHFFFAOYSA-NAKOS000678802NSC-171310ST51190239
Database identifiers
- CAS
58338-55-9- PubChem CID
- 298936
- DTXSID
DTXSID50305638
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 212 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 2
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 590
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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