Basic information
- CAS
51325-37-2- Standard SMILES
CCC=CCC=CC=CC=O- InChIKey
KEXCNWISTVJVBV-UHFFFAOYSA-N- Molecular formula
- C10H14O
- Average molar mass
- 150.22 g/mol
- Monoisotopic mass
- 150.10446507
Overview
Deca-2,4,7-trienal has been reported in Thalassiosira gravida and Thalassiosira rotula with data available.
Names & identifiers
- Preferred name
- Deca-2,4,7-trienal
- IUPAC
- deca-2,4,7-trienal
Names & synonyms
Deca-2,4,7-trienalDTXSID90867240RefChem:131140DTXCID008154392,4,7-decatrien-1-alSCHEMBL887175SCHEMBL7296452RCA64286(E,E,Z)-2,4,7-decatrien-1-alNS00122799
Database identifiers
- CAS
51325-37-2- PubChem CID
- 181747
- DTXSID
DTXSID90867240
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 164
Experimental & physicochemical properties
Density0.900-0.904
Flavoring AgentsEU Flavoring substances
Solubility
Practically insoluble or insoluble in water
Soluble (in ethanol)
Boiling Point232-234 °C
Refractive Index1.538-1.544
Physical DescriptionOrange liquid; Green, citrusy aroma
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Regulatory InformationCommission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)
Chemistry & industry
Uses & manufacturing
Use ClassificationFlavoring Agents -> JECFA Flavorings Index
Related reactions
1 records
Compound notes
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