Isopropyl chloroacetate

Isopropyl chloroacetate Basic information
Product Name:Isopropyl chloroacetate
Synonyms:1-methylethylchloroethanoate;Acetic acid, chloro-, 1-methylethyl ester;Acetic acid, chloro-, isopropyl ester;Chloroacetic acid 1-methylethyl ester;Isopropyl chloroacetate,99%;Aceticacid,chloro-,1-methylethylester;aceticacid,chloro-,isopropylester;Chloroacetic acid, 1-methyl ester
CAS:105-48-6
MF:C5H9ClO2
MW:136.58
EINECS:203-301-7
Product Categories:API Intermediate
Mol File:105-48-6.mol
Isopropyl chloroacetate Structure
Isopropyl chloroacetate Chemical Properties
Boiling point 149-150 °C(lit.)
density 1.096 g/mL at 25 °C(lit.)
refractive index n20/D 1.419(lit.)
Fp 159 °F
form clear liquid
color Colorless to Almost colorless
Water Solubility SLIGHTLY SOLUBLE
CAS DataBase Reference105-48-6(CAS DataBase Reference)
NIST Chemistry ReferenceChloroacetic acid isopropyl ester(105-48-6)
EPA Substance Registry SystemAcetic acid, chloro-, 1-methylethyl ester (105-48-6)
Safety Information
Hazard Codes T
Risk Statements 10-25-36/37/38
Safety Statements 26-37/39-45-1/2
RIDADR UN 2947 3/PG 3
WGK Germany 1
TSCA Yes
HazardClass 3
PackingGroup III
HS Code 29154000
MSDS Information
ProviderLanguage
(1-Methylethyl)-2-chloroacetate English
SigmaAldrich English
ACROS English
ALFA English
Isopropyl chloroacetate Usage And Synthesis
Chemical PropertiesCLEAR COLOURLESS TO ALMOST COLOURLESS LIQUID
UsesIsopropyl Chloroacetate is used as a reactant in the design, synthesis, and 3D-QSAR analysis of novel oxadiazolones as protoporphyrinogen oxidase inhibitors.
General DescriptionA clear colorless liquid. Flash point near 60°F. Boiling point near 200°F. Less dense than water. Vapors heavier than air. Used to make other chemicals.
Air & Water ReactionsHighly flammable. Soluble in water.
Reactivity ProfileIsopropyl chloroacetate 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 HazardTOXIC; inhalation, ingestion or contact (skin, eyes) with vapors, dusts or substance may cause severe injury, burns or death. Bromoacetates and chloroacetates are extremely irritating/lachrymators. Reaction with water or moist air will release toxic, corrosive or flammable gases. Reaction with water may generate much heat that will increase the concentration of fumes in the air. Fire will produce irritating, corrosive and/or toxic gases. Runoff from fire control or dilution water may be corrosive and/or toxic and cause pollution.
Fire HazardHIGHLY FLAMMABLE: Will be easily ignited by heat, sparks or flames. Vapors form explosive mixtures with air: indoors, outdoors and sewers explosion hazards. Most vapors are heavier than air. They will spread along ground and collect in low or confined areas (sewers, basements, tanks). Vapors may travel to source of ignition and flash back. Substance will react with water (some violently) releasing flammable, toxic or corrosive gases and runoff. Contact with metals may evolve flammable hydrogen gas. Containers may explode when heated or if contaminated with water.
Isopropyl chloroacetate Preparation Products And Raw materials
Preparation ProductsThiophene-2-ethylamine-->Diisopropyl malonate
Diisopropyl malonate 2-ISOPROPYL-5-METHYLCYCLOHEXYL CHLOROACETATE 3-CHLORO-5-(CHLOROMETHYL)-5-METHYL-4-PHENYL-2,5-DIHYDROFURAN-2-ONE 1-phenylethyl 2-chloroacetoacetate AURORA KA-996 ISOPROPYL LAURATE DIISOPROPYL DICHLOROMALONATE 6-CHLORO-2,2-DIMETHYLPERHYDRO[1,3]DIOXOLO[4',5':4,5]FURO[3,2-B]PYRAN-5-ONE DIISOPROPYL CHLOROMALONATE TERT-BUTYL-2-CHLORO-2-TRIMETHYLSILYLACETATE CHOLESTERYL CHLOROACETATE 3,4-DICHLORO-5-PHENYL-2(5H)-FURANONE isopropyl trichloroacetate AURORA KA-1002 Isopropyl chloroacetate (+)-8-PHENYLMENTHYL CHLOROACETATE TESTOSTERONE DICHLOROACETATE 2,2'-Thiobispropane

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