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CAS 695187-30-5

:

(2E)-3-(5-Chloro-2,4-difluorophenyl)-2-propenoic acid

Description:
(2E)-3-(5-Chloro-2,4-difluorophenyl)-2-propenoic acid, with the CAS number 695187-30-5, is an organic compound characterized by its propenoic acid structure, which features a double bond between the second and third carbon atoms. The presence of a 5-chloro-2,4-difluorophenyl group indicates that the compound has significant halogen substitution, which can influence its reactivity and biological activity. This compound is likely to exhibit properties typical of unsaturated carboxylic acids, such as acidity due to the carboxyl functional group, and potential for undergoing various chemical reactions, including addition and substitution reactions. The halogen atoms can enhance lipophilicity and may affect the compound's interaction with biological targets, making it of interest in medicinal chemistry. Additionally, the specific stereochemistry indicated by the (2E) configuration suggests that the compound has a defined geometric arrangement, which can be crucial for its biological activity and interaction with enzymes or receptors. Overall, this compound's unique structure may confer specific properties that are valuable in pharmaceutical applications or material science.
Formula:C9H5ClF2O2
InChI:InChI=1S/C9H5ClF2O2/c10-6-3-5(1-2-9(13)14)7(11)4-8(6)12/h1-4H,(H,13,14)/b2-1+
InChI key:InChIKey=AXQLBJZFLDRWAD-OWOJBTEDSA-N
SMILES:C(=C/C(O)=O)\C1=C(F)C=C(F)C(Cl)=C1
Synonyms:
  • 2-Propenoic acid, 3-(5-chloro-2,4-difluorophenyl)-, (2E)-
  • (2E)-3-(5-Chloro-2,4-difluorophenyl)-2-propenoic acid
  • trans-3-(2,4-Difluoro-5-chlorophenyl)-2-propenoic acid
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