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Basic information
- Standard SMILES
CCOC(=O)C(=CNC(C)CO)C(=O)c1c(F)c(F)c(Br)c(F)c1F- InChIKey
UMGOZCJPSKQLBX-UHFFFAOYSA-N- Molecular formula
- C15H14BrF4NO4
- Average molar mass
- 428.17 g/mol
- Monoisotopic mass
- 427.00423
Names & identifiers
- IUPAC
- ethyl 2-(4-bromo-2,3,5,6-tetrafluorobenzoyl)-3-(1-hydroxypropan-2-ylamino)prop-2-enoate
Database identifiers
- PubChem CID
- 88624952
Properties
Computed structural propertiesFilling in
- XLogP
- 3.7
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 8
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 506
Related reactions
1 records
Compound notes
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