hexyl isobutyrate

Full Material List
hexyl 2-methylpropanoate

Identifiers

FEMA 3172
CAS 7/7/49
EINECS 219-075-8
Synonyms
  • iso butyric acid hexyl ester
  • iso butyric acid, hexyl ester
  • hexyl 2-methyl propanoate
  • hexyl 2-methyl propionate
  • hexyl 2-methylpropanoate
  • hexyl 2-methylpropionate
  • hexyl iso butyrate
  • hexyl isobutanoate
  • N- hexyl isobutanoate
  • 1- hexyl isobutyrate
  • N- hexyl isobutyrate
  • nat. hexyl isobutyrate
  • hexyl isobutyrate natural
  • hexyl-iso-butyrate
  • hexyle isobutyrate
  • hexylisobutyrate
  • 2- methyl propanoic acid hexyl ester
  • 2- methylpropanoic acid hexyl ester
  • propanoic acid, 2-methyl-, hexyl ester
JECFA Food Flavoring 189
JECFA Food Additive N/A
DG SANTE Food Flavourings 09.478 hexyl isobutyrate
DG SANTE Food Contact Materials N/A
FDA UNII 5FC79GHU69
CoE Number 646
XlogP3-AA 3.50 (est)
Molecular Weight 172.2678
Molecular Formula C10 H20 O2

Organoleptic

Organoleptic Notes
  • 1. Odor Type: green Odor Strength:medium
  • Substantivity: > 2 hour(s) at 100.00 %
  • fruity green apple pear tart grape berry ripe berry winey peach
  • Odor Description:at 100.00 %. green fruity apple pear tart grape ripe berry winey peachLuebke, William tgsc, (2017)
  • Odor sample from: Vigon International
  • sweet green fruity apple pear ripe peach berry
  • Odor Description:Sweet, green, fruity, apple- and pear-like with ripe peach and berry nuancesMosciano, Gerard P&F 20, No. 3, 63, (1995)
Odor green
fruity, green, apple, pear, tart, grape, berry, ripe, winey, peach, sweet
Flavor green
green, fruity, apple, fruit, ripe, pear, banana, winey, grassy, sweet, melon

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Properties

Food Chemicals Codex Listed No
Appearance colorless clear liquid (est)
Assay 98.00 to 100.00
Specific Gravity N/A
Lbs/Gal (est) N/A
Refractive Index N/A
Melting Point N/A
Boiling Point 198.00 to 199.00 °C. @ 760.00 mm Hg
Flash Point 164.00 °F. TCC ( 73.33 °C. )
Acid Value N/A
Vapor Pressure 0.413000 mmHg @ 25.00 °C. (est)
Vapor Density 5.9 ( Air = 1 )
logP (o/w) 3.686 (est)
Soluble In
  • alcohol
  • propylene glycol
  • water, very slightly
  • water, 38.59 mg/L @ 25 °C (est)
  • water
  • alcoholic, good
  • antiperspirant spray, moderate
  • ph = 10, moderate
  • ph = 2 poor
  • powder detergent, good
  • soap, good
  • toiletry, good
Occurrence
  • apple fruit
  • apricot fruit
  • beer
  • brandy apple brandy
  • grape mascat grape
  • heracleum paphlagonicum czeczott fruit oil turkey @ 2.40%
  • hop oil
  • lavandin oil abrialis @ 0.14%
  • lavandin oil grosso @ 0.04%
  • lavender oil spike france @ trace%
  • lavender oil spike spain @ 0.15%
  • plum fruit
  • quince fruit
  • sherry
  • strawberry wild strawberry fruit
  • wine white wine