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HomeProduct name listDichloroacetic acid methyl ester

Dichloroacetic acid methyl ester

Synonym(s):Dichloroacetic acid methyl ester;NSC 2882

  • CAS NO.:116-54-1
  • Empirical Formula: C3H4Cl2O2
  • Molecular Weight: 142.97
  • MDL number: MFCD00000843
  • EINECS: 204-146-8
  • SAFETY DATA SHEET (SDS)
  • Update Date: 2023-04-23 13:52:06
Dichloroacetic acid methyl ester Structural

What is Dichloroacetic acid methyl ester?

Chemical properties

clear colorless liquid

The Uses of Dichloroacetic acid methyl ester

Dichloroacetic Acid Methyl Ester is used in the preparation of telechelics and block copolymers through living radical polymerization.

The Uses of Dichloroacetic acid methyl ester

Organic intermediate.

The Uses of Dichloroacetic acid methyl ester

Methyl dichloroacetate may be used:

  • in the diastereoselctive synthesis of bicyclic chlorocyclopropane
  • as difunctional initiator during atom transfer radical polymerization of methyl or n-butyl acrylate
  • as reagent during CrCl2-induced olefination of aldehydes

Synthesis Reference(s)

Journal of the American Chemical Society, 90, p. 5307, 1968 DOI: 10.1021/ja01021a065
The Journal of Organic Chemistry, 28, p. 1133, 1963

General Description

A colorless liquid with an ethereal odor. Combustible. Flash point 176°F. Corrosive to metals and tissue. Used to make other chemicals.

Air & Water Reactions

Decomposed by water to dichloroacetic acid, a corrosive material with evolution of heat [USCG, 1999].

Reactivity Profile

Dichloroacetic acid methyl ester produces toxic fumes of phosgene and HCl when heated [USCG, 1999].

Hazard

Strong irritant to tissue. Forms corrosiveproducts on hydrolysis, keep dry.

Health Hazard

Extremely destructive to the eyes, nose, throat, and upper respiratory tract. May be fatal as a result of spasm, inflammation and edema of the larynx and bronchi, chemical pneumonitis, and pulmonary edema. Symptoms of exposure include burning sensation, coughing, wheezing, laryngitis, shortness of breath, headache, nausea, and vomiting.

Fire Hazard

Special Hazards of Combustion Products: Produces toxic fumes of phosgene and HCl.

Safety Profile

Poisonous irritant to the skin, eyes, and mucous membranes. Hydrolyzes upon contact with moisture to form a product corrosive to tissue. See also DICHLOROACETIC ACID and ESTERS. Dangerous; when heated to decomposition it emits hghly toxic fumes of phosgene and Cl-.

Properties of Dichloroacetic acid methyl ester

Melting point: -52 °C (lit.)
Boiling point: 143 °C (lit.)
Density  1.381 g/mL at 25 °C (lit.)
refractive index  n20/D 1.442(lit.)
Flash point: 176 °F
storage temp.  room temp
solubility  4g/l
form  Liquid
color  Clear colorless
PH 3.8 (4g/l, H2O, 20℃)
Water Solubility  Slightly soluble
BRN  1747542
CAS DataBase Reference 116-54-1(CAS DataBase Reference)
NIST Chemistry Reference Acetic acid, dichloro-, methyl ester(116-54-1)
EPA Substance Registry System Acetic acid, 2,2-dichloro-, methyl ester (116-54-1)

Safety information for Dichloroacetic acid methyl ester

Signal word Warning
Pictogram(s)
ghs
Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H332:Acute toxicity,inhalation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P271:Use only outdoors or in a well-ventilated area.
P302+P352:IF ON SKIN: wash with plenty of soap and water.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

Computed Descriptors for Dichloroacetic acid methyl ester

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