2,6-Dinitro-4-(trifluoromethyl)benzamide
Basic information
- CAS
65517-11-5- Standard SMILES
NC(=O)c1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-]- InChIKey
FLLULEVATOIQCT-UHFFFAOYSA-N- Molecular formula
- C8H4F3N3O5
- Average molar mass
- 279.13 g/mol
- Monoisotopic mass
- 279.01030472
Names & identifiers
- Preferred name
- 2,6-Dinitro-4-(trifluoromethyl)benzamide
- IUPAC
- 2,6-dinitro-4-(trifluoromethyl)benzamide
Names & synonyms
2,6-dinitro-4-(trifluoromethyl)benzamideNSC62264065517-11-5NCIMech_000171CHEMBL1976293DTXSID40326938CCG-35243NSC-622640NCI60_006681PD0115012,6-Bis(hydroxy(oxido)amino)-4-(trifluoromethyl)benzamide
Database identifiers
- CAS
65517-11-5- PubChem CID
- 360506
- DTXSID
DTXSID40326938- ChEMBL
CHEMBL1976293
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 135 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 378
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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