Basic information
- Standard SMILES
CCOC(=O)c1cccc(CBr)c1F- InChIKey
AODWMRAVAMQAQE-UHFFFAOYSA-N- Molecular formula
- C10H10BrFO2
- Average molar mass
- 261.09 g/mol
Names & identifiers
- Preferred name
- Ethyl 3-(bromomethyl)-2-fluorobenzoate
- IUPAC
- ethyl 3-(bromomethyl)-2-fluorobenzoate
Names & synonyms
ethyl 3-(bromomethyl)-2-fluorobenzoate1006619-22-2SCHEMBL12407022AODWMRAVAMQAQE-UHFFFAOYSA-Nethyl3-(bromomethyl)-2-fluorobenzoateDB-108786
Database identifiers
- PubChem CID
- 58009396
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 199
Related reactions
2 records
Compound notes
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