Allyl (3-methylbutoxy)acetate

Allyl (3-methylbutoxy)acetate Basic information
Product Name:Allyl (3-methylbutoxy)acetate
Synonyms:2-(3-Methylbutoxy)acetic acid allyl ester;2-(Isopentyloxy)acetic acid allyl ester;2-isoamoxyacetic acid allyl ester;prop-2-enyl 2-(3-methylbutoxy)ethanoate;Ally amyl glycolate;Allyl 2-(isopentyloxy)acetate;G peng ester;Acetic acid, 2-(3-methylbutoxy)-, 2-propen-1-yl ester
CAS:67634-00-8
MF:C10H18O3
MW:186.25
EINECS:266-803-5
Product Categories:ester series;A-B;Alphabetical Listings;Flavors and Fragrances
Mol File:67634-00-8.mol
Allyl (3-methylbutoxy)acetate Structure
Allyl (3-methylbutoxy)acetate Chemical Properties
Boiling point 206-226 °C(lit.)
density 0.937 g/mL at 25 °C(lit.)
vapor pressure 19.7Pa at 25℃
refractive index n20/D 1.4317(lit.)
Fp 205 °F
form clear liquid
color Colorless to Very pale yellow
Odorat 10.00 % in dipropylene glycol. fruity green galbanum pineapple fusel
Odor Typefruity
Water Solubility 1μg/L at 20℃
InChIInChI=1S/C10H18O3/c1-4-6-13-10(11)8-12-7-5-9(2)3/h4,9H,1,5-8H2,2-3H3
InChIKeyXCWPXUNHSPOFGV-UHFFFAOYSA-N
SMILESC(OCC=C)(=O)COCCC(C)C
LogP1.96 at 25℃
CAS DataBase Reference67634-00-8(CAS DataBase Reference)
EPA Substance Registry SystemAcetic acid, 2-(3-methylbutoxy)-, 2-propen-1-yl ester (67634-00-8)
Safety Information
Hazard Codes Xi
Risk Statements 36/37/38
Safety Statements 26-36
WGK Germany 2
RTECS AI8988000
HS Code 2916.19.3000
MSDS Information
ProviderLanguage
Allyl isoamyl glycolate English
SigmaAldrich English
Allyl (3-methylbutoxy)acetate Usage And Synthesis
Chemical PropertiesAllyl (3-Methylbutoxy)acetate is a colorless liquid of strong, fruity galbanum odor with pineapple modification. It can be prepared by reaction of chloroacetic acid with isoamyl alcohol in the presence of sodium hydroxide and a phase-transfer catalyst, then treating the resulting sodium amylglycolate with allyl alcohol. Allyl amylglycolate is used in fragrance compositions, for example, for detergents.
General DescriptionClear colorless liquid.
Air & Water ReactionsInsoluble in water.
Reactivity ProfileAllyl (3-methylbutoxy)acetate may react with strong oxidizing acids sufficiently exothermically to ignite the reaction products. Also generates heat with caustic solutions. May generate flammable hydrogen with alkali metals, hydrides, and other reducing agents.
Fire HazardAllyl (3-methylbutoxy)acetate is combustible.
Flammability and ExplosibilityNotclassified
Allyl (3-methylbutoxy)acetate Preparation Products And Raw materials
Raw materials3-Methyl-1-butanol
Allyl phenoxyacetate Diallyl phthalate Methacryloyl chloride ALLYL ACRYLATE Allyl glycidyl ether Pivalic acid Allyl cyclohexylpropionate Allyl (3-methylbutoxy)acetate (2-Propenyl) 3-oxobutanoate 3-Methyl-1-butene Isopropyl acetate N,N'-Methylenebisacrylamide Ammonium acetate Allyl alcohol Allyl isothiocyanate Propyl acetate Allyl hexanoate Methacrylamide

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