Basic information
- CAS
928-67-6- Standard SMILES
C=C(C)C=CC=C(C)C- InChIKey
UTPOSGXXIJEVFD-UHFFFAOYSA-N- Molecular formula
- C9H14
- Average molar mass
- 122.21 g/mol
- Monoisotopic mass
- 122.10955045
Names & identifiers
- Preferred name
- 2,6-Dimethylhepta-1,3,5-triene
- IUPAC
- 2,6-dimethylhepta-1,3,5-triene
Names & synonyms
SCHEMBL4444235SCHEMBL11132487
Database identifiers
- CAS
928-67-6- PubChem CID
- 276166
- DTXSID
DTXSID601376721
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 143
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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