3,3,8-Trimethyldecane

HCID 44006

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Basic information

CAS: 62338-16-3
Standard SMILES: CCC(C)CCCCC(C)(C)CC
InChIKey: IWDBBRKPCLWIKU-UHFFFAOYSA-N
Molecular formula: C13H28
Average molar mass: 184.36 g/mol
Monoisotopic mass: 184.21910089

Names & identifiers

Preferred name: 3,3,8-Trimethyldecane
IUPAC: 3,3,8-trimethyldecane
English name: 3,3,8-Trimethyldecane
Molecular formula: C13H28
Molecular weight: 184.36

Names & synonyms

3,3,8-TRIMETHYLDECANE62338-16-3DTXSID10977895RefChem:1065586DTXCID001405227Decane, 3,3,8-trimethyl-3,3,8-Trimethyldecane #IWDBBRKPCLWIKU-UHFFFAOYSA-NDECANE,3,3,8-TRIMETHYL-DB-304656DB-324309

Database identifiers

CAS: 62338-16-3
PubChem CID: 44006
DTXSID: DTXSID10977895
Nikkaji: J124.745J

Properties

Computed structural properties

XLogP: 6.5
Topological polar surface area: 0 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 0
Rotatable bonds: 7
Heavy atoms: 13
Formal charge: 0
Complexity: 113

Physicochemical properties

Boiling point: 219.3 · 219.3±7.0 °C(Predicted)
Density: 0.756 · 0.756±0.06 g/cm3(Predicted)

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