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CAS 1047975-16-5

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(1S)-1-Carboxyethyl 4-chlorobenzoate

Description:
(1S)-1-Carboxyethyl 4-chlorobenzoate is an organic compound characterized by its carboxyethyl and chlorobenzoate functional groups. It features a chiral center, which contributes to its stereochemistry, specifically the (1S) configuration. This compound typically exhibits moderate solubility in polar solvents due to the presence of the carboxylic acid group, while its aromatic ring may impart some hydrophobic characteristics. The 4-chloro substituent on the benzoate moiety can influence its reactivity and interactions, potentially enhancing electrophilic substitution reactions. As a derivative of benzoic acid, it may participate in various chemical reactions, including esterification and nucleophilic substitutions. The presence of both the carboxylic acid and ester functionalities suggests potential applications in organic synthesis and medicinal chemistry. Additionally, the compound's stereochemistry may play a crucial role in its biological activity, making it of interest in pharmacological studies. Overall, (1S)-1-Carboxyethyl 4-chlorobenzoate is a versatile compound with potential applications in various fields of chemistry and biochemistry.
Formula:C10H9ClO4
InChI:InChI=1S/C10H9ClO4/c1-6(9(12)13)15-10(14)7-2-4-8(11)5-3-7/h2-6H,1H3,(H,12,13)/t6-/m0/s1
InChI key:InChIKey=PPRDDFIRQKQEQN-LURJTMIESA-N
SMILES:C(O[C@H](C(O)=O)C)(=O)C1=CC=C(Cl)C=C1
Synonyms:
  • Benzoic acid, 4-chloro-, (1S)-1-carboxyethyl ester
  • (1S)-1-Carboxyethyl 4-chlorobenzoate
  • (S)-O-(p-Chlorobenzoyl)lactic acid
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