1-(3-Bromopropoxy)-2-butylbenzene
Basic information
- CAS
40786-33-2- Standard SMILES
CCCCc1ccccc1OCCCBr- InChIKey
ZVFGESWVJCYOEN-UHFFFAOYSA-N- Molecular formula
- C13H19BrO
- Average molar mass
- 271.19 g/mol
- Monoisotopic mass
- 270.06193
Names & identifiers
- Preferred name
- 1-(3-Bromopropoxy)-2-butylbenzene
- IUPAC
- 1-(3-bromopropoxy)-2-butylbenzene
Names & synonyms
DTXSID0012991751-(3-Bromopropoxy)-2-butylbenzene40786-33-2
Database identifiers
- CAS
40786-33-2- PubChem CID
- 13091007
- DTXSID
DTXSID001299175
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 7
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 149
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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