Basic information
- CAS
4955-32-2- Standard SMILES
C=CC(C)=CCC=C(C)CCC=C(C)C=O- InChIKey
PFSTYGCNVAVZBK-UHFFFAOYSA-N- Molecular formula
- C15H22O
- Average molar mass
- 218.33 g/mol
- Monoisotopic mass
- 218.16706532
Names & identifiers
- Preferred name
- 2,6,9,11-Dodecatetraenal, 2,6,10-trimethyl-
- IUPAC
- 2,6,10-trimethyldodeca-2,6,9,11-tetraenal
Names & synonyms
2,6,9,11-Dodecatetraenal, 2,6,10-trimethyl-DTXSID5063655RefChem:83063DTXCID80406962,6,10-TRIMETHYL-2,6,9,11-DODECATETRAENAL.beta.-SinensalSCHEMBL713641PFSTYGCNVAVZBK-UHFFFAOYSA-NSAA90977
Database identifiers
- CAS
4955-32-2- PubChem CID
- 21064
- DTXSID
DTXSID5063655
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 7
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 316
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2,6,9,11-Dodecatetraenal, 2,6,10-trimethyl-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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