Basic information
- CAS
6864-53-5- Standard SMILES
CC(C)CCCC(C)CCCC(C)C- InChIKey
RMDGVETXJWRSGT-UHFFFAOYSA-N- Molecular formula
- C14H30
- Average molar mass
- 198.39 g/mol
- Monoisotopic mass
- 198.23475096
Names & identifiers
- Preferred name
- 2,6,10-Trimethylundecane
- IUPAC
- 2,6,10-trimethylundecane
- English name
- 2,6,10-Trimethylundecane
- Molecular formula
- C14H30
- Molecular weight
- 198.39
Names & synonyms
2,6,10-TRIMETHYLUNDECANE6864-53-5Undecane, 2,6,10-trimethyl-DTXSID6075069RefChem:1060187DTXCID6046185Undecane, 2,6,10-trimethylUndecane,2,6,10-trimethyl-2,6,10-trimethyl-undecaneSCHEMBL538230SCHEMBL4290473SCHEMBL28179508
Show more names
2,6,10-Trimethylundecane in isooctane
AKOS006271740DB-239553Undecane, 2,6,10-trimethyl, isomer # 1
Database identifiers
- CAS
6864-53-5- PubChem CID
- 23296
- DTXSID
DTXSID6075069- Nikkaji
- J1.555.635H
Properties
Computed structural properties
- XLogP
- 6.9
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 8
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 99.2
Experimental & physicochemical properties
SpringerMaterials PropertiesOptical coefficient
Physicochemical properties
- Boiling point
- 227 °C · 227 °C
- Density
- 0.763 g/cm3 · 0.763 g/cm3
- EPA Substance Registry System
- 2 · Undecane, 2,6,10-trimethyl- (6864-53-5)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers4 total
坛墨质检科技股份有限公司4008-099-669 · [email protected]
CHEMSAMPCO[email protected]
CHIRON[email protected]
上海甄准生物科技有限公司15800340161 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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