5-Ethyl-5-methyldecane
Basic information
- CAS
17312-74-2- Standard SMILES
CCCCCC(C)(CC)CCCC- InChIKey
METKCQZZZVWWCD-UHFFFAOYSA-N- Molecular formula
- C13H28
- Average molar mass
- 184.36 g/mol
- Monoisotopic mass
- 184.21910089
Overview
5-Ethyl-5-methyldecane has been reported in Magnolia officinalis with data available.
Names & identifiers
- Preferred name
- 5-Ethyl-5-methyldecane
- IUPAC
- 5-ethyl-5-methyldecane
- English name
- 5-Ethyl-5-methyldecane
- Molecular formula
- C13H28
- Molecular weight
- 184.36
Names & synonyms
5-ETHYL-5-METHYLDECANE17312-74-2DTXSID10938325RefChem:535554DTXCID301366864Decane, 5-ethyl-5-methyl-5-ethyl-5-methyl-decane5-Ethyl-5-methyldecane #SCHEMBL5984571SCHEMBL11646996
Database identifiers
- CAS
17312-74-2- PubChem CID
- 28473
- DTXSID
DTXSID10938325- Nikkaji
- J99.433B
Properties
Computed structural properties
- XLogP
- 6.8
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 8
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 107
Experimental & physicochemical properties
Chemical ClassesOther Classes -> Aliphatics, Saturated (>C11)
Physicochemical properties
- Boiling point
- 102 · 102-103 °C(Press: 15 Torr)
- Density
- 0.758 · 0.758±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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