Basic information
- CAS
62237-99-4- Standard SMILES
CCCC(C)CCCCC(C)(C)C- InChIKey
WABCXPNFLLYYCV-UHFFFAOYSA-N- Molecular formula
- C13H28
- Average molar mass
- 184.36 g/mol
- Monoisotopic mass
- 184.21910089
Names & identifiers
- Preferred name
- 2,2,7-Trimethyldecane
- IUPAC
- 2,2,7-trimethyldecane
- English name
- 2,2,7-Trimethyldecane
- Molecular formula
- C13H28
- Molecular weight
- 184.36
Names & synonyms
2,2,7-TRIMETHYLDECANE62237-99-4Decane, 2,2,7-trimethyl-2,2,7-Trimethyldecane #SCHEMBL20509870SCHEMBL25384365DTXSID00977809WABCXPNFLLYYCV-UHFFFAOYSA-NDB-355028
Database identifiers
- CAS
62237-99-4- PubChem CID
- 43963
- DTXSID
DTXSID00977809- Nikkaji
- J125.237B
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 7
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 108
Physicochemical properties
- Boiling point
- 213 · 213.0±7.0 °C(Predicted)
- Density
- 0.756 · 0.756±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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