Basic information
- Standard SMILES
O=[N+]([O-])c1cc([N+](=O)[O-])c(C(F)(F)F)c([N+](=O)[O-])c1- InChIKey
ORELKHWIHXMBIL-UHFFFAOYSA-N- Molecular formula
- C7H2F3N3O6
- Average molar mass
- 281.1 g/mol
Names & identifiers
- Preferred name
- 1-Trifluoromethyl2,4,6-trinitrobenzene
- IUPAC
- 1,3,5-trinitro-2-(trifluoromethyl)benzene
Names & synonyms
1-trifluoromethyl2,4,6-trinitrobenzeneSCHEMBL9761462SCHEMBL11547377
Database identifiers
- PubChem CID
- 11780946
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 137 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 373
Related reactions
1 records
Compound notes
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