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CAS 773135-52-7

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Ethyl 2-chloro-3,6-difluorobenzoate

Description:
Ethyl 2-chloro-3,6-difluorobenzoate is an organic compound characterized by its ester functional group, specifically an ethyl ester derived from benzoic acid. The presence of chlorine and fluorine substituents on the aromatic ring significantly influences its chemical properties and reactivity. The chlorine atom, being electronegative, can enhance the compound's polarity, while the fluorine atoms contribute to its overall stability and lipophilicity. This compound is typically a colorless to pale yellow liquid or solid, depending on its purity and temperature. It is soluble in organic solvents and may exhibit low solubility in water due to its hydrophobic characteristics. Ethyl 2-chloro-3,6-difluorobenzoate is of interest in various fields, including pharmaceuticals and agrochemicals, due to its potential applications in synthesis and as an intermediate in chemical reactions. Safety precautions should be observed when handling this compound, as it may pose health risks if ingested or inhaled, and appropriate measures should be taken to mitigate exposure.
Formula:C9H7ClF2O2
InChI:InChI=1S/C9H7ClF2O2/c1-2-14-9(13)7-5(11)3-4-6(12)8(7)10/h3-4H,2H2,1H3
InChI key:InChIKey=MPNZVNFLBJNGBX-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C1=C(Cl)C(F)=CC=C1F
Synonyms:
  • Ethyl 2-chloro-3,6-difluorobenzoate
  • Benzoic acid, 2-chloro-3,6-difluoro-, ethyl ester
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