Basic information
- Standard SMILES
O=C(Nc1ncc(C(F)(F)F)cc1[N+](=O)[O-])C(F)(F)C(F)(F)C(F)(F)F- InChIKey
GEOOCUIJNWOEOJ-UHFFFAOYSA-N- Molecular formula
- C10H3F10N3O3
- Average molar mass
- 403.13 g/mol
Names & identifiers
- Preferred name
- 5-(Trifluoromethyl)-3-nitro-2-(2,2,3,3,4,4,4-heptafluorobutyramido)pyridine
- IUPAC
- 2,2,3,3,4,4,4-heptafluoro-N-[3-nitro-5-(trifluoromethyl)-2-pyridinyl]butanamide
Names & synonyms
5-(trifluoromethyl)-3-nitro-2-(2,2,3,3,4,4,4-heptafluorobutyramido)pyridineSCHEMBL116307395-(trifluoromethyl)-3-nitro-2-(2,2,3,3,4,4,4,-heptafluorobutyramido)pyridine
Database identifiers
- PubChem CID
- 20355488
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 87.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 14
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 556
Related reactions
4 records
Compound notes
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