Basic information
- CAS
61868-42-6- Standard SMILES
CCC(C)CC(C)C(C)(C)C- InChIKey
KXNFNEAZTWCHIL-UHFFFAOYSA-N- Molecular formula
- C11H24
- Average molar mass
- 156.31 g/mol
- Monoisotopic mass
- 156.18780077
Names & identifiers
- Preferred name
- 2,2,3,5-Tetramethylheptane
- IUPAC
- 2,2,3,5-tetramethylheptane
Names & synonyms
2,2,3,5-Tetramethylheptane61868-42-6DTXSID20337986RefChem:1058976DTXCID80289073Heptane, 2,2,3,5-tetramethyl-SCHEMBL19068813SCHEMBL206370552,2,3,5-Tetramethylheptane #HEPTANE,2,2,3,5-TETRAMETHYL-
Database identifiers
- CAS
61868-42-6- PubChem CID
- 545795
- DTXSID
DTXSID20337986
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 97.1
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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