Basic information
- Standard SMILES
CCc1ccccc1OCCCCBr- InChIKey
WLNAVVIFRUQNBM-UHFFFAOYSA-N- Molecular formula
- C12H17BrO
- Average molar mass
- 257.17 g/mol
Names & identifiers
- Preferred name
- 1-(4-Bromobutoxy)-2-ethylbenzene
- IUPAC
- 1-(4-bromobutoxy)-2-ethylbenzene
Names & synonyms
1-(4-bromobutoxy)-2-ethylbenzeneSCHEMBL3061095WLNAVVIFRUQNBM-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 43364277
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 138
Related reactions
5 records
Compound notes
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