Basic information
- Standard SMILES
CCOC(=O)COCc1cccc(Br)c1- InChIKey
WLIQDDLZGHDRHA-UHFFFAOYSA-N- Molecular formula
- C11H13BrO3
- Average molar mass
- 273.12 g/mol
Names & identifiers
- Preferred name
- Ethyl 3-bromobenzyloxyacetate
- IUPAC
- ethyl 2-[(3-bromophenyl)methoxy]acetate
Names & synonyms
ethyl 3-bromobenzyloxyacetateSCHEMBL7035447WLIQDDLZGHDRHA-UHFFFAOYSA-NAKOS021147302
Database identifiers
- PubChem CID
- 19958320
- Nikkaji
- J2.939.785F
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 196
Related reactions
2 records
Compound notes
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