109-20-6

Name GERANYL ISOVALERATE
CAS 109-20-6
EINECS(EC#) 203-655-2
Molecular Formula C15H26O2
MDL Number MFCD00036514
Molecular Weight 238.37
MOL File 109-20-6.mol
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Chemical Properties

Boiling point  279 °C(lit.)
density  0.89 g/mL at 25 °C(lit.)
FEMA  2518
refractive index  n20/D 1.458(lit.)
Fp  113 °C
storage temp.  Store at room temperature
solubility  Insoluble in water, soluble in alcohol and oils
form  oily liquid
color  A colourless oily liquid.
Odor at 100.00 %. green fruity apple blueberry pineapple
biological source synthetic
Odor Type fruity
JECFA Number 75
Major Application flavors and fragrances
Cosmetics Ingredients Functions PERFUMING
InChI 1S/C15H26O2/c1-12(2)7-6-8-14(5)9-10-17-15(16)11-13(3)4/h7,9,13H,6,8,10-11H2,1-5H3/b14-9+
InChIKey SOUKTGNMIRUIQN-NTEUORMPSA-N
SMILES CC(C)CC(=O)OC\C=C(/C)CC\C=C(\C)C
LogP 5.47
Uses
Geranyl Isovalerate is a synthetic flavoring agent that is a moderately stable, light yellow liquid of fruity odor. it should be stored in glass or tin containers. it is used in fruit flavors such as apple or pear with applications in beverages, ice cream, candy, and baked goods at 4–11 ppm.
CAS DataBase Reference 109-20-6(CAS DataBase Reference)
EPA Substance Registry System Butanoic acid, 3-methyl-, (2E)-3,7-dimethyl-2,6-octadienyl ester (109-20-6)
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Safety Data

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
WGK Germany  2
RTECS  RG5927700
TSCA  TSCA listed
Storage Class 10 - Combustible liquids
Safety Profile
A skin irritant. When heated to decomposition it emits acrid smoke and irritating fumes. See also ESTERS.
Toxicity
Both the acute oral LD50 value in rats and the acute dermal LD50 value in rabbits exceeded 5 g/kg (Levenstein, 1975).

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