2,2-Dimethyltetradecane
Basic information
- CAS
59222-86-5- Standard SMILES
CCCCCCCCCCCCC(C)(C)C- InChIKey
VCAMXEBNASZVEZ-UHFFFAOYSA-N- Molecular formula
- C16H34
- Average molar mass
- 226.44 g/mol
- Monoisotopic mass
- 226.26605109
Names & identifiers
- Preferred name
- 2,2-Dimethyltetradecane
- IUPAC
- 2,2-dimethyltetradecane
- English name
- 2,2-dimethyltetradecane
- Molecular formula
- C16H34
- Molecular weight
- 226.44
Names & synonyms
2,2-Dimethyltetradecane59222-86-5Tetradecane, 2,2-dimethyl-trimethyltridecane2,2-dimethyl-tetradecane2,2-Dimethyltetradecane #SCHEMBL384068SCHEMBL912577SCHEMBL2259007SCHEMBL2723911SCHEMBL6676535SCHEMBL6890254
Show more names
DTXSID001351157TETRADECANE,2,2-DIMETHYL-
Database identifiers
- CAS
59222-86-5- PubChem CID
- 545801
- DTXSID
DTXSID001351157
Properties
Computed structural properties
- XLogP
- 8.4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 11
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 129
Experimental & physicochemical properties
SpringerMaterials PropertiesOptical coefficient
Physicochemical properties
- Melting point
- -3.71 °C · -3.71°C (estimate)
- Boiling point
- 274 °C · 274°C
- Density
- 0.7668 · 0.7668
- refractive index
- 1.4302 · 1.4302
- Henry's Law Constant
- 6.5 · 6.5×10-6 mol/(m3Pa) at 25℃, Yaws (2003)
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Compound notes
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