Basic information
- Standard SMILES
O=C(CCCCCCCBr)OCc1ccccc1- InChIKey
VXXTYYTXGKGFOY-UHFFFAOYSA-N- Molecular formula
- C15H21BrO2
- Average molar mass
- 313.23 g/mol
Names & identifiers
- Preferred name
- Benzyl 8-bromooctanoate
- IUPAC
- benzyl 8-bromooctanoate
Names & synonyms
Benzyl 8-bromooctanoatebenzyl-8-bromoctanoateSCHEMBL1365591VXXTYYTXGKGFOY-UHFFFAOYSA-NA1-49344
Database identifiers
- PubChem CID
- 11278409
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 10
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 213
Related reactions
3 records
Compound notes
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