2,3-Dimethylhexa-1,4-diene
Basic information
- CAS
18669-52-8- Standard SMILES
C=C(C)C(C)C=CC- InChIKey
QGDVKFLWAVKNAA-UHFFFAOYSA-N- Molecular formula
- C8H14
- Average molar mass
- 110.2 g/mol
- Monoisotopic mass
- 110.10955045
Names & identifiers
- Preferred name
- 2,3-Dimethylhexa-1,4-diene
- IUPAC
- 2,3-dimethylhexa-1,4-diene
Names & synonyms
SCHEMBL7346202,3-dimethylhexa-1,4-dieneSCHEMBL28449609
Database identifiers
- CAS
18669-52-8- PubChem CID
- 29198
- DTXSID
DTXSID901311186
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 98.6
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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