Basic information
- CAS
62108-26-3- Standard SMILES
CCC(C)CC(C)CCCC(C)C- InChIKey
SWDJLVOSNCGQGB-UHFFFAOYSA-N- Molecular formula
- C13H28
- Average molar mass
- 184.36 g/mol
- Monoisotopic mass
- 184.21910089
Overview
2,6,8-trimethyldecane is an alkane that is decane substituted by a methyl group at positions 2,6 and 8. It is a combustion product of natural gas. It has a role as a volatile oil component, a mammalian metabolite, a plant metabolite, a fungal metabolite and a human metabolite. It is a volatile organic compound and an alkane.
Names & identifiers
- Preferred name
- 2,6,8-Trimethyldecane
- IUPAC
- 2,6,8-trimethyldecane
- English name
- 2,6,8-Trimethyldecane
- Molecular formula
- C13H28
- Molecular weight
- 184.36
Names & synonyms
2,6,8-Trimethyldecane62108-26-3CHEBI:88814DTXSID50337934RefChem:1060206DTXCID10289021Decane, 2,6,8-trimethyl-2,6,8-trimethyl-decane2,6,8-Trimethyldecane #SCHEMBL9595174DB-355312NS00096002
Show more names
Q27160787
Database identifiers
- CAS
62108-26-3- PubChem CID
- 545608
- DTXSID
DTXSID50337934- ChEBI
CHEBI:88814- Nikkaji
- J121.163C
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 7
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 105
Physicochemical properties
- Boiling point
- 213.1 · 213.1±7.0 °C(Predicted)
- Density
- 0.754 · 0.754±0.06 g/cm3(Predicted)
Chemistry & industry
Pharmacology
Cellular LocationsMembrane
Additional notes
DefinitionChEBI: 2,6,8-trimethyldecane is an alkane that is decane substituted by a methyl group at positions 2,6 and 8. It is a combustion product of natural gas. It has a role as a mammalian metabolite, a human metabolite, a plant metabolite, a volatile oil component and a fungal metabolite. It is an alkane and a volatile organic compound.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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