5-Phenyltetradecane
Basic information
- CAS
4534-56-9- Standard SMILES
CCCCCCCCCC(CCCC)c1ccccc1- InChIKey
RAWFVRXBPRHWLJ-UHFFFAOYSA-N- Molecular formula
- C20H34
- Average molar mass
- 274.5 g/mol
- Monoisotopic mass
- 274.26605109
Names & identifiers
- Preferred name
- 5-Phenyltetradecane
- IUPAC
- tetradecan-5-ylbenzene
Names & synonyms
5-PhenyltetradecaneBenzene, (1-butyldecyl)-4534-56-9(tetradecan-5-yl)benzeneBenzene, (1-butyldecyl)SCHEMBL980261SCHEMBL17423122DTXSID90875289
Database identifiers
- CAS
4534-56-9- PubChem CID
- 20639
- DTXSID
DTXSID90875289- Nikkaji
- J1.583.962G
Properties
Computed structural properties
- XLogP
- 9
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 12
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 190
Experimental & physicochemical properties
Chemical ClassesAlkylbenzene
LogP9.16
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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