Basic information
- Standard SMILES
CCOC(=O)C(=O)Nc1ccc(Cl)cc1C(F)(F)F- InChIKey
SFEGNHXTMWQDDB-UHFFFAOYSA-N- Molecular formula
- C11H9ClF3NO3
- Average molar mass
- 295.64 g/mol
- Monoisotopic mass
- 295.0223053
Names & identifiers
- Preferred name
- Ethyl 2-[4-chloro-2-(trifluoromethyl)anilino]-2-oxoacetate
- IUPAC
- ethyl 2-[4-chloro-2-(trifluoromethyl)anilino]-2-oxoacetate
Names & synonyms
5-chloro-2-ethoxalylaminobenzotrifluorideN-ethoxalyl-4-chloro-2-trifluoromethylanilineSCHEMBL7328337ethyl 2-[4-chloro-2-(trifluoromethyl)anilino]-2-oxoacetateAKOS008969182AQ-911/41960082ethyl [4-chloro-2-(trifluoromethyl)anilino](oxo)acetate
Database identifiers
- PubChem CID
- 4550962
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 349
Related reactions
4 records
Compound notes
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