10-Undecen-2-one
Basic information
- CAS
36219-73-5- Standard SMILES
C=CCCCCCCCC(C)=O- InChIKey
FJHNSGVMPSITEQ-UHFFFAOYSA-N- Molecular formula
- C11H20O
- Average molar mass
- 168.28 g/mol
- Monoisotopic mass
- 168.15141526
Overview
10-Undecen-2-one is a ketone.
Names & identifiers
- Preferred name
- 10-Undecen-2-one
- IUPAC
- undec-10-en-2-one
- English name
- undec-10-en-2-one
- Molecular formula
- C11H20O
- Molecular weight
- 168.2759
Names & synonyms
10-undecen-2-oneUndec-10-en-2-oneEINECS 252-924-0UNII-86926W49Y286926W49Y2FEMA NO. 4406DTXSID9018977210-UNDECEN-2-ONE [FHFI]RefChem:77648DTXCID5011226336219-73-5SCHEMBL3112070
Show more names
SCHEMBL7864417CHEBI:169645FJHNSGVMPSITEQ-UHFFFAOYSA-NLMFA12000157NS00022099Q27269721
Database identifiers
- CAS
36219-73-5- PubChem CID
- 118928
- DTXSID
DTXSID90189772- ChEBI
CHEBI:169645- UNII
- 86926W49Y2
- EC Number
- 252-924-0
- Nikkaji
- J319.613E
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 8
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 127
Experimental & physicochemical properties
LipidsFatty Acyls [FA] -> Oxygenated hydrocarbons [FA12]
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Density0.843-0.847
Solubility
Practically insoluble to insoluble in water
Soluble (in ethanol)
Boiling Point
254.00 to 255.00 °C. @ 760.00 mm Hg
81-82 °C (3 mm Hg)
Refractive Index1.440-1.441
Physical DescriptionColourless to pale yellow liquid; Citrus, fatty aroma
Physicochemical properties
- FEMA
- 4406 · 4406 | 10-UNDECEN-2-ONE
- Odor
- 100 % · at 100.00 %. citrus fatty
- Odor Type
Chemistry & industry
Pharmacology
Cellular LocationsMembrane
Uses & manufacturing
Use Classification
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavoring Agents -> JECFA Flavorings Index
Applications
OccurrenceReported found in Pinus mugo oil.
Upstream & downstream products
Downstream products
Additional notes
DefinitionChEBI: 10-Undecen-2-one is a ketone.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…