Basic information
- CAS
55000-55-0- Standard SMILES
CCCCCCc1cccc2ccc(CCCC)cc12- InChIKey
LPEFBGSLSJQKAH-UHFFFAOYSA-N- Molecular formula
- C20H28
- Average molar mass
- 268.4 g/mol
- Monoisotopic mass
- 268.21910089
Names & identifiers
- Preferred name
- 7-Butyl-1-hexylnaphthalene
- IUPAC
- 7-butyl-1-hexylnaphthalene
- English name
- 7-Butyl-1-hexylnaphthalene
- Molecular formula
- C20H28
- Molecular weight
- 268.44
Names & synonyms
7-Butyl-1-hexylnaphthaleneNaphthalene, 7-butyl-1-hexyl-55000-55-07-Butyl-1-hexylnaphthalene #SCHEMBL30589485DTXSID30334683LPEFBGSLSJQKAH-UHFFFAOYSA-NDB-318302
Database identifiers
- CAS
55000-55-0- PubChem CID
- 521561
- DTXSID
DTXSID30334683- Nikkaji
- J114.076K
Properties
Computed structural properties
- XLogP
- 8
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 8
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 244
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Physicochemical properties
- Boiling point
- 346.6 °C · 346.6°C (rough estimate)
- Density
- 0.945 · 0.9450 (rough estimate)
- refractive index
- 1.55 · 1.5500 (estimate)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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