Basic information
- CAS
27796-57-2- Standard SMILES
COc1cccc(C(=O)OCCBr)c1- InChIKey
AYGLAAMIOKSUMW-UHFFFAOYSA-N- Molecular formula
- C10H11BrO3
- Average molar mass
- 259.1 g/mol
- Monoisotopic mass
- 257.98916
Names & identifiers
- Preferred name
- 2-Bromoethyl 3-methoxybenzoate
- IUPAC
- 2-bromoethyl 3-methoxybenzoate
Names & synonyms
27796-57-22-bromoethyl 3-methoxybenzoateNSC131999DTXSID20299676NSC-131999
Database identifiers
- CAS
27796-57-2- PubChem CID
- 280397
- DTXSID
DTXSID20299676
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 184
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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