Basic information
- Standard SMILES
O=C1Nc2ccc(CCNC(=O)C(F)(F)F)cc2C1=O- InChIKey
UMPOBRMUWJTMIC-UHFFFAOYSA-N- Molecular formula
- C12H9F3N2O3
- Average molar mass
- 286.21 g/mol
Names & identifiers
- Preferred name
- 5-(2-Trifluoroacetylaminoethyl)-isatin
- IUPAC
- N-[2-(2,3-dioxo-1H-indol-5-yl)ethyl]-2,2,2-trifluoroacetamide
Names & synonyms
5-(2-trifluoroacetylaminoethyl)-isatinSCHEMBL8687563
Database identifiers
- PubChem CID
- 19708564
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 75.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 436
Related reactions
2 records
Compound notes
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