Ethyl 3-bromo-3-phenylpropanoate
Basic information
- CAS
1884-29-3- Standard SMILES
CCOC(=O)CC(Br)c1ccccc1- InChIKey
UJSACSSBHKEXIH-UHFFFAOYSA-N- Molecular formula
- C11H13BrO2
- Average molar mass
- 257.12 g/mol
- Monoisotopic mass
- 256.00989
Names & identifiers
- Preferred name
- Ethyl 3-bromo-3-phenylpropanoate
- IUPAC
- ethyl 3-bromo-3-phenylpropanoate
Names & synonyms
ethyl 3-bromo-3-phenylpropanoate1884-29-3DTXSID50289601RefChem:343346DTXCID00240747NSC62191NCIOpen2_002812SCHEMBL27322176NSC-62191ETHYL 3-BROMO-3-PHENYL-PROPANOATEDS-011017
Database identifiers
- CAS
1884-29-3- PubChem CID
- 247498
- DTXSID
DTXSID50289601
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 176
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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