2,6-Dimethylnonane
Basic information
- CAS
17302-28-2- Standard SMILES
CCCC(C)CCCC(C)C- InChIKey
MGNGOEWESNDQAN-UHFFFAOYSA-N- Molecular formula
- C11H24
- Average molar mass
- 156.31 g/mol
- Monoisotopic mass
- 156.18780077
Overview
2,6-dimethylnonane is an alkane.
Names & identifiers
- Preferred name
- 2,6-Dimethylnonane
- IUPAC
- 2,6-dimethylnonane
- English name
- Nonane,2,6-dimethyl-
- Molecular formula
- C11H24
- Molecular weight
- 156.31
Names & synonyms
2,6-DIMETHYLNONANENonane, 2,6-dimethyl-17302-28-2DTXSID80938276RefChem:83328DTXCID001366815MGNGOEWESNDQAN-UHFFFAOYSA-N2,6-dimethyl-nonaneNonane,2,6-dimethyl-SCHEMBL386229SCHEMBL1968684SCHEMBL2687685
Show more names
4,8-Dimethylnonane
SCHEMBL28161495CHEBI:183301LMFA11000614
Database identifiers
- CAS
17302-28-2- PubChem CID
- 28457
- DTXSID
DTXSID80938276- ChEBI
CHEBI:183301- Nikkaji
- J125.011F
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 6
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 74.1
Experimental & physicochemical properties
LipidsFatty Acyls [FA] -> Hydrocarbons [FA11]
SolventsSolvents -> Aliphatics, Saturated (<C12)
SpringerMaterials PropertiesBoiling point
Physicochemical properties
- Melting point
- -57.06 °C · -57.06°C (estimate)
- Boiling point
- 179 °C · 179°C
- Density
- 0.7368 · 0.7368
- refractive index
- 1.4143 · 1.4143
- Henry's Law Constant
- 1.1 · 1.1×10-6 mol/(m3Pa) at 25℃, Yaws (2003)
- EPA Substance Registry System
- 2 · Nonane, 2,6-dimethyl- (17302-28-2)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Toxicology
Adverse EffectsNeurotoxin - Acute solvent syndrome
Chemistry & industry
Upstream & downstream products
Downstream products
Additional notes
DefinitionChEBI: 2,6-dimethyl-Nonane is an alkane.
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Related reactions
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Compound notes
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