Isoamyl propionate

Isoamyl propionate Basic information
Product Name:Isoamyl propionate
Synonyms:isoamyl;iso-Amyl n-propionate;Isopentyl alcohol, propionate;isopentylalcohol,propionate;Isopentylpropanate;propanoicacid3-methylbutylester;Propionic acid, isopentyl ester;propionicacid,isopentylester
CAS:105-68-0
MF:C8H16O2
MW:144.21
EINECS:203-322-1
Product Categories:Certified Natural ProductsFlavors and Fragrances;Alphabetical Listings;Flavors and Fragrances;I-L
Mol File:105-68-0.mol
Isoamyl propionate Structure
Isoamyl propionate Chemical Properties
Melting point -70.1°C (estimate)
Boiling point 156 °C (lit.)
density 0.871 g/mL at 25 °C (lit.)
vapor pressure 13.331hPa at 51.27℃
FEMA 2082 | ISOAMYL PROPIONATE
refractive index n20/D 1.406(lit.)
Fp 118 °F
storage temp. Store below +30°C.
solubility Slightly soluble in water
form clear liquid
color Colorless to Almost colorless
Odorat 100.00 %. sweet fruity banana pineapple ripe tropical fruit
Odor Typefruity
explosive limit1%(V)
Water Solubility 194.505mg/L at 25℃
JECFA Number44
LogP3.365 at 25℃
CAS DataBase Reference105-68-0(CAS DataBase Reference)
NIST Chemistry ReferenceIsoamyl propionate(105-68-0)
EPA Substance Registry System1-Butanol, 3-methyl-, propanoate (105-68-0)
Safety Information
Risk Statements 10
Safety Statements 16-27-36/37/39-24-23
RIDADR UN 3272 3/PG 3
WGK Germany 1
RTECS NT0190000
Autoignition Temperature370 °C
HazardClass 3.2
PackingGroup III
HS Code 29155000
ToxicityLD50 orally in Rabbit: > 5000 mg/kg LD50 dermal Rabbit > 5000 mg/kg
MSDS Information
ProviderLanguage
Isoamyl propionate English
SigmaAldrich English
Isoamyl propionate Usage And Synthesis
DescriptionIsoamyl propionate has an apricot-pineapple odor. The taste is somewhat harsh when freshly distilled but subsequently yields apleasant apricot-plum bittersweet flavor. May be prepared by esterification of propionic acid with the isomeric amyl alcohols obtained from fusel oil and other sources.
Chemical PropertiesIsoamyl propionate has a pineapple–apricot odor. The taste is somewhat harsh when freshly distilled, but subsequently yields a pleasant apricot–plum, bittersweet flavor
Chemical PropertiesClear colorless liquid
OccurrenceReported found in Bulgarian peppermint, cocoa, apple, melon, tomato, Camembert and Gruyere cheese, hop oil, beer, cognac, rum, cider, red and white wine, apple wine and brandy, cherimoya and custard apple
UsesPerfumes, lacquers, flavors.
DefinitionChEBI: A propanoate ester of isoamylol.
PreparationBy esterification of propionic acid with the isomeric amyl alcohols obtained from fusel oil and other sources.
Aroma threshold valuesDetection: 8.6 to 43 ppb; aroma characteristics at 2.0%: sweet, estry, fruity apple, banana with a fresh green, slightly tropical nuance
Taste threshold valuesTaste characteristics at 30 ppm: sweet, banana, fruity, tutti-frutti, apple, melon, tropical and pineapple-like.
HazardFire hazard.
Flammability and ExplosibilityFlammable
Biochem/physiol ActionsTaste at 30 ppm
MetabolismEsters such as propionates are hydrolysed to materials that are normally in the diet or are readily converted to such materials (Fassett, 1963a). The lower toxicities of the higher propionate esters (isoamyl < n-butyl < n-propyl < ethyl) and of the higher isoamyl esters (isovalerate < n-butyrate < propionate < acetate) were attributed to their slower rates of hydrolysis, which made less free alcohol available (Selisko, Ackermann & Kupke, 1962). The metabolism of propionic acid is known to proceed by conversion to succinic acid and oxidation through the citric acid cycle(Fassett, 1963b).
Isoamyl propionate Preparation Products And Raw materials
Raw materials3-Methyl-1-butanol
Isoamyl butyrate Isobutyl methacrylate 2,2-Bis(hydroxymethyl)propionic acid (2-METHYL-1H-INDOL-3-YL)-OXO-ACETIC ACID ETHYL ESTER Isoamyl nitrite Ethyl propionate Butyl methacrylate ISOAMYL NITRATE propanoate Calcium Propionate Isoamyl acetate LACTIC ACID ISOAMYL ESTER 3-Methylbutyl 3-methylbutanoate TERT-BUTYL PROPIONATE Isoamyl nitrate γ-Methylbutyl nitrate 3-Methyl-1-butanol Di-iso-amyl phthalate Butyl propionate Amyl Propionate

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