Basic information
- CAS
53496-16-5- Standard SMILES
CCC(CC)(CC)Cc1ccccc1- InChIKey
KHFNTMYMCUFFKF-UHFFFAOYSA-N- Molecular formula
- C14H22
- Average molar mass
- 190.32 g/mol
- Monoisotopic mass
- 190.1721507
Names & identifiers
- Preferred name
- 2,2-Diethylbutylbenzene
- IUPAC
- 2,2-diethylbutylbenzene
Names & synonyms
53496-16-52,2-diethylbutylbenzene(2,2-diethylbutyl)benzene
Database identifiers
- CAS
53496-16-5- PubChem CID
- 40786
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 130
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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