Cyclohexane, 1-(1,5-dimethylhexyl)-4-(4-methylpentyl)-
Basic information
- CAS
56009-20-2- Standard SMILES
CC(C)CCCC1CCC(C(C)CCCC(C)C)CC1- InChIKey
OGABIDLNGVAJFL-UHFFFAOYSA-N- Molecular formula
- C20H40
- Average molar mass
- 280.5 g/mol
- Monoisotopic mass
- 280.31300128
Names & identifiers
- Preferred name
- Cyclohexane, 1-(1,5-dimethylhexyl)-4-(4-methylpentyl)-
- IUPAC
- 1-(6-methylheptan-2-yl)-4-(4-methylpentyl)cyclohexane
- English name
- 2-methyl-6-[4-(4-methylpentyl)cyclohexyl]heptane
- Molecular formula
- C20H40
- Molecular weight
- 280.53
Names & synonyms
1-(1,5-Dimethylhexyl)-4-(4-methylpentyl)cyclohexane56009-20-2Cyclohexane, 1-(1,5-dimethylhexyl)-4-(4-methylpentyl)-DTXSID40873250RefChem:335192DTXCID908207541-(6-methylheptan-2-yl)-4-(4-methylpentyl)cyclohexaneOGABIDLNGVAJFL-UHFFFAOYSA-N1-(1,5-Dimethylhexyl)-4-(4-methylpentyl)cyclohexane #2-methyl-6-[4-(4-methylpentyl)cyclohexyl]heptane
Database identifiers
- CAS
56009-20-2- PubChem CID
- 41687
- DTXSID
DTXSID40873250- Nikkaji
- J128.390A
Properties
Computed structural properties
- XLogP
- 9.4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 9
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 220
Experimental & physicochemical properties
Chemical ClassesOther Classes -> Aliphatics, Saturated (>C11)
SpringerMaterials PropertiesDensity
Physicochemical properties
- Boiling point
- 174 · 174-176 °C(Press: 9 Torr)
- Density
- 0.8526 g/cm3 · 0.8526 g/cm3
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Related reactions
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Compound notes
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