1-[4-(4-Bromocyclohexyl)butyl]-4-chlorobenzene
Basic information
- CAS
181804-90-0- Standard SMILES
Clc1ccc(CCCCC2CCC(Br)CC2)cc1- InChIKey
CKJJAYAILSPERB-UHFFFAOYSA-N- Molecular formula
- C16H22BrCl
- Average molar mass
- 329.7 g/mol
- Monoisotopic mass
- 328.05934
Names & identifiers
- Preferred name
- 1-[4-(4-Bromocyclohexyl)butyl]-4-chlorobenzene
- IUPAC
- 1-[4-(4-bromocyclohexyl)butyl]-4-chlorobenzene
Names & synonyms
1-[4-(4-bromocyclohexyl)butyl]-4-chlorobenzeneSCHEMBL7766068DTXSID201246110181804-90-0
Database identifiers
- CAS
181804-90-0- PubChem CID
- 22913633
- DTXSID
DTXSID201246110
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 215
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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