2,6-Octadiene
Basic information
- CAS
4974-27-0- Standard SMILES
CC=CCCC=CC- InChIKey
LAGGTOBQMQHXON-UHFFFAOYSA-N- Molecular formula
- C8H14
- Average molar mass
- 110.2 g/mol
- Monoisotopic mass
- 110.10955045
Overview
2,6-octadiene is an alkadiene that is octane with the two double bonds located at positions 2 and 6.
Names & identifiers
- Preferred name
- 2,6-Octadiene
- IUPAC
- octa-2,6-diene
Names & synonyms
2,6-Octadiene4974-27-0CHEBI:111518RefChem:1060348octa-2,6-diene1,6-Dimethyldiallyln-Octa-2,6-dienSCHEMBL59994SCHEMBL354192SCHEMBL1775468SCHEMBL2884669SCHEMBL3173296
Show more names
SCHEMBL3499180SCHEMBL4914467SCHEMBL6634748SCHEMBL6656261DTXSID70871108Q27191233
Database identifiers
- CAS
4974-27-0- PubChem CID
- 138396
- DTXSID
DTXSID70871108- ChEBI
CHEBI:111518
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 3
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 66
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
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Related reactions
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Compound notes
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