1-(2-Ethylbutyl)-4-(4-phenoxybutoxy)benzene
Basic information
- CAS
125797-02-6- Standard SMILES
CCC(CC)Cc1ccc(OCCCCOc2ccccc2)cc1- InChIKey
SXATVPPWOLJALJ-UHFFFAOYSA-N- Molecular formula
- C22H30O2
- Average molar mass
- 326.5 g/mol
- Monoisotopic mass
- 326.2245802
Names & identifiers
- Preferred name
- 1-(2-Ethylbutyl)-4-(4-phenoxybutoxy)benzene
- IUPAC
- 1-(2-ethylbutyl)-4-(4-phenoxybutoxy)benzene
Names & synonyms
1-(2-ethylbutyl)-4-(4-phenoxybutoxy)benzene125797-02-6Benzene, 1-(2-ethylbutyl)-4-(4-phenoxybutoxy)-DTXSID80154934
Database identifiers
- CAS
125797-02-6- PubChem CID
- 180396
- DTXSID
DTXSID80154934
Properties
Computed structural properties
- XLogP
- 6.9
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 11
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 286
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Compound notes
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