4,4-Diethylheptane
Basic information
- CAS
17302-21-5- Standard SMILES
CCCC(CC)(CC)CCC- InChIKey
WDTMGYSKSAMSPF-UHFFFAOYSA-N- Molecular formula
- C11H24
- Average molar mass
- 156.31 g/mol
- Monoisotopic mass
- 156.18780077
Names & identifiers
- Preferred name
- 4,4-Diethylheptane
- IUPAC
- 4,4-diethylheptane
Names & synonyms
4,4-diethylheptaneDTXSID4033536317302-21-5RefChem:1069325DTXCID90286452Heptane, 4,4-diethyl-SCHEMBL11014082SCHEMBL16287226SCHEMBL17607388SCHEMBL28199383WDTMGYSKSAMSPF-UHFFFAOYSA-N
Database identifiers
- CAS
17302-21-5- PubChem CID
- 524813
- DTXSID
DTXSID40335363
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 6
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 72
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
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Related reactions
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Compound notes
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