Basic information
- Standard SMILES
O=C(CC(=O)C(F)(F)F)c1cccc(Cl)n1- InChIKey
KDUCYXBELYGXSF-UHFFFAOYSA-N- Molecular formula
- C9H5ClF3NO2
- Average molar mass
- 251.59 g/mol
Names & identifiers
- Preferred name
- 2-Chloro-6-(trifluoroacetoacetyl)pyridine
- IUPAC
- 1-(6-chloro-2-pyridinyl)-4,4,4-trifluorobutane-1,3-dione
Names & synonyms
2-chloro-6-(trifluoroacetoacetyl)pyridineSCHEMBL7254186
Database identifiers
- PubChem CID
- 11601268
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 47 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 293
Related reactions
1 records
Compound notes
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