2,6-Dimethylhepta-2,4-diene
Basic information
- CAS
4634-87-1- Standard SMILES
CC(C)=CC=CC(C)C- InChIKey
HQTKNGJJNNTBLG-UHFFFAOYSA-N- Molecular formula
- C9H16
- Average molar mass
- 124.22 g/mol
- Monoisotopic mass
- 124.12520051
Names & identifiers
- Preferred name
- 2,6-Dimethylhepta-2,4-diene
- IUPAC
- 2,6-dimethylhepta-2,4-diene
Names & synonyms
4634-87-12,6-Dimethyl-2,4-heptadiene2,6-dimethylhepta-2,4-dieneSCHEMBL4981346SCHEMBL7296679SCHEMBL8200653DTXSID30963553
Database identifiers
- CAS
4634-87-1- PubChem CID
- 572971
- DTXSID
DTXSID30963553
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 112
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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