Basic information
- CAS
72894-15-6- Standard SMILES
C=CCCCCCCCCC=CC=O- InChIKey
QIKYGYCMRRQODW-UHFFFAOYSA-N- Molecular formula
- C13H22O
- Average molar mass
- 194.31 g/mol
- Monoisotopic mass
- 194.16706532
Names & identifiers
- Preferred name
- 2,12-Tridecadienal
- IUPAC
- trideca-2,12-dienal
Names & synonyms
2,12-Tridecadienal72894-15-6EINECS 276-966-4DTXSID1072632RefChem:80514DTXCID9047384SCHEMBL18941590NS00037422
Database identifiers
- CAS
72894-15-6- PubChem CID
- 166346
- DTXSID
DTXSID1072632- EC Number
- 276-966-4
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 10
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 159
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: 2,12-Tridecadienal
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2,12-Tridecadienal: ACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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