Isobutyl propionate

Isobutyl propionate
  • CAS No.:540-42-1
Other grades of this product :
Isobutyl propionate Basic information
Product Name:Isobutyl propionate
Synonyms:Propionic acid (2-methylpropyl) ester;Propionic acid 2-methylpropyl ester;Propionic acid isobutyl;isobutyl propionate >=99.0%;Natural Isobutyl Propionate;i-Butylpropionat;Isobutyl ester of propanoic acid;iso-Butyl n-propionate
CAS:540-42-1
MF:C7H14O2
MW:130.18
EINECS:208-746-0
Product Categories:Carbonyl Compounds;Esters;Alphabetical Listings;Flavors and Fragrances;I-L;C6 to C7
Mol File:540-42-1.mol
Isobutyl propionate Chemical Properties
Melting point −71 °C(lit.)
Boiling point 66.5 °C
density 0.869 g/mL at 25 °C(lit.)
refractive index n20/D 1.397(lit.)
FEMA 2212 | ISOBUTYL PROPIONATE
Fp 80 °F
storage temp. Flammables area
solubility 1.7g/l
form Liquid
color Colorless
Odor Threshold0.02ppm
explosive limit1.1-7.5%(V)
JECFA Number148
Merck 14,5150
InChIKeyFZXRXKLUIMKDEL-UHFFFAOYSA-N
CAS DataBase Reference540-42-1(CAS DataBase Reference)
NIST Chemistry ReferencePropanoic acid, 2-methylpropyl ester(540-42-1)
EPA Substance Registry SystemPropanoic acid, 2-methylpropyl ester (540-42-1)
Safety Information
Risk Statements 10
Safety Statements 16
RIDADR UN 2394 3/PG 3
WGK Germany 2
RTECS UF4930000
HazardClass 3.2
PackingGroup III
HS Code 29159000
MSDS Information
ProviderLanguage
ACROS English
SigmaAldrich English
Isobutyl propionate Usage And Synthesis
DescriptionIsobutyl propionate has an odor similar to the corresponding ethyl ester but more refined and fresher. It has a bitter flavor. Prepared by direct esterification or by reacting propionyl chloride with isobutyl alcohol in the presence of Mg dust in ether solution.
Chemical PropertiesIsobutyl propionate, has an odor similar to the corresponding ethyl ester, but more refined and fresher. It has a bitter flavor
Chemical Propertiesclear colorless liquid
OccurrenceReported found in grapes, hop oil, apple, pear, rum, apricot, melon, Gruyere and Parmesan cheese, cider, mushroom, quince, Bourbon vanilla and spineless monkey orange
Usesmanufacture of fruit essences.
PreparationBy direct esterification or by reacting propionyl chloride with isobutyl alcohol in the presence of Mg dust in ether solution.
Aroma threshold valuesAroma characteristics at 1.0%: fruity, sweet, rummy, pungent, bubble gum estry with a tropical nuance
Taste threshold valuesTaste characteristics at 10 ppm: sweet, fruity, banana, tutti-frutti, with rummy nuances
General DescriptionA colorless liquid. Flash point of 86°F. Less dense than water. Vapors heavier than air. May be mildly toxic by ingestion, inhalation and skin absorption. Used to make plastics.
Air & Water ReactionsHighly flammable. Slightly soluble in water.
Reactivity ProfileIsobutyl propionate is an ester. Esters react with acids to liberate heat along with alcohols and acids. Strong oxidizing acids may cause a vigorous reaction that is sufficiently exothermic to ignite the reaction products. Heat is also generated by the interaction of esters with caustic solutions. Flammable hydrogen is generated by mixing esters with alkali metals and hydrides.
Health HazardMay cause toxic effects if inhaled or absorbed through skin. Inhalation or contact with material may irritate or burn skin and eyes. Fire will produce irritating, corrosive and/or toxic gases. Vapors may cause dizziness or suffocation. Runoff from fire control or dilution water may cause pollution.
Fire HazardHIGHLY FLAMMABLE: Will be easily ignited by heat, sparks or flames. Vapors may form explosive mixtures with air. Vapors may travel to source of ignition and flash back. Most vapors are heavier than air. They will spread along ground and collect in low or confined areas (sewers, basements, tanks). Vapor explosion hazard indoors, outdoors or in sewers. Runoff to sewer may create fire or explosion hazard. Containers may explode when heated. Many liquids are lighter than water.
Safety ProfileMldly toxic by ingestion. Flammable when exposed to heat or flame, can react vigorously with oxidizing materials. When heated to decomposition it emits acrid smoke and irritating fumes. See also ESTERS, PROPIONIC ACID, and ISOBUTYL ALCOHOL.
Isobutyl propionate Preparation Products And Raw materials
Raw materialsPropionic acid-->2-Methyl-1-propanol

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