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Ethyl fluoroacetate
[CAS# 459-72-3]

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Complete supplier list of Ethyl fluoroacetate
Identification
Classification Organic raw materials >> Carboxylic compounds and derivatives >> Carboxylic esters and their derivatives
Name Ethyl fluoroacetate
Molecular Structure CAS # 459-72-3, Ethyl fluoroacetate
Molecular Formula C4H7FO2
Molecular Weight 106.10
CAS Registry Number 459-72-3
EC Number 207-297-8
SMILES CCOC(=O)CF
Properties
Density 1.0±0.1 g/cm3, Calc.*, 1.093 g/mL (Expl.)
Index of Refraction 1.354, Calc.*,1.375 (Expl.)
Boiling Point 118.0±8.0 ºC (760 mmHg), Calc.*, 119.6 ºC (Expl.)
Flash Point 30.0 ºC, Calc.*, 30 ºC (Expl.)
* Calculated using Advanced Chemistry Development (ACD/Labs) Software.
Safety Data
Hazard Symbols symbol symbol symbol   GHS02;GHS06;GHS09 Danger    Details
Hazard Statements H226-H300-H310-H330-H400    Details
Precautionary Statements P210-P233-P240-P241-P242-P243-P260-P262-P264-P270-P271-P273-P280-P284-P301+P316-P302+P352-P303+P361+P353-P304+P340-P316-P320-P321-P330-P361+P364-P370+P378-P391-P403+P233-P403+P235-P405-P501    Details
Hazard Classification
up    Details
HazardClassCategory CodeHazard Statement
Acute toxicityAcute Tox.2H300
Flammable liquidsFlam. Liq.3H226
Acute toxicityAcute Tox.2H330
Acute toxicityAcute Tox.2H310
Acute hazardous to the aquatic environmentAquatic Acute1H400
Skin corrosionSkin Corr.1BH314
Serious eye damageEye Dam.1H318
Acute toxicityAcute Tox.1H310
Acute toxicityAcute Tox.1H330
Transport Information UN 2929
SDS Available
up Discovory and Applicatios
Ethyl fluoroacetate is an organic compound with the molecular formula C4H7FO2. It is a colorless liquid with a pungent odor, and it is commonly used as a chemical intermediate in the synthesis of various compounds. Ethyl fluoroacetate is primarily known for its applications in the synthesis of pharmaceuticals and agrochemicals, and it has significant importance in organic chemistry due to its ability to introduce fluorine into organic molecules.

Ethyl fluoroacetate was first synthesized in the early 20th century, with its primary role in chemical synthesis being identified over time. The compound contains both a fluoroacetate group (-CO2CH2F) and an ethyl ester group (-C2H5), making it a versatile intermediate for the creation of more complex chemical structures. The presence of the fluorine atom in the structure of ethyl fluoroacetate plays a crucial role in its chemical properties, such as increasing its reactivity and altering the metabolic behavior of the compounds it is used to synthesize.

One of the key applications of ethyl fluoroacetate is in the pharmaceutical industry, where it is used as an intermediate for the synthesis of various bioactive molecules. Fluorine substitution often leads to improved bioactivity, stability, and lipophilicity of pharmaceutical compounds, making ethyl fluoroacetate valuable in drug development. In particular, its use in the preparation of fluorinated drugs, which can enhance their pharmacokinetic properties, is of significant importance.

In agrochemicals, ethyl fluoroacetate has been utilized as a precursor in the synthesis of certain herbicides and pesticides. The ability to incorporate fluorine into organic molecules makes it a useful building block for designing chemicals with specific biological activity. Its role in agrochemical production has led to its application in formulations that target plant pathogens or weeds.

Additionally, ethyl fluoroacetate has been employed in laboratory research, particularly in studies related to the synthesis of fluorinated organic compounds. Researchers use it as a reagent to introduce fluorine atoms into molecular structures, contributing to the development of new materials or chemicals with unique properties.

While ethyl fluoroacetate has useful applications, it is important to note that it is highly toxic. It can act as a potent inhibitor of enzymes in biological systems, particularly in the central nervous system, which contributes to its toxicological profile. As a result, handling ethyl fluoroacetate requires caution and appropriate safety measures.

Overall, ethyl fluoroacetate is an important compound in organic chemistry, particularly for the synthesis of fluorinated pharmaceuticals, agrochemicals, and other organic molecules. Its ability to introduce fluorine into complex molecules enhances the properties and reactivity of the final products, making it a valuable tool in chemical synthesis.
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