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CAS 129511-07-5

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Methyl 4-(acetylamino)-5-chloro-2-hydroxy-3-(2-propen-1-yl)benzoate

Description:
Methyl 4-(acetylamino)-5-chloro-2-hydroxy-3-(2-propen-1-yl)benzoate, with the CAS number 129511-07-5, is an organic compound characterized by its complex structure, which includes a benzoate moiety substituted with various functional groups. This compound features an acetylamino group, a chloro substituent, and a propenyl side chain, contributing to its potential reactivity and biological activity. The presence of the hydroxyl group indicates that it can participate in hydrogen bonding, which may influence its solubility and interaction with other molecules. The chloro group can enhance the compound's lipophilicity, potentially affecting its pharmacokinetic properties. Methyl esters, like this compound, are often used in medicinal chemistry for their ability to modify biological activity. The specific arrangement of substituents suggests that it may exhibit unique properties, making it of interest in various fields, including pharmaceuticals and agrochemicals. However, detailed studies would be necessary to fully understand its behavior and applications in these areas.
Formula:C13H14ClNO4
InChI:InChI=1S/C13H14ClNO4/c1-4-5-8-11(15-7(2)16)10(14)6-9(12(8)17)13(18)19-3/h4,6,17H,1,5H2,2-3H3,(H,15,16)
InChI key:InChIKey=HAFRYROUUMEXHM-UHFFFAOYSA-N
SMILES:C(C=C)C1=C(NC(C)=O)C(Cl)=CC(C(OC)=O)=C1O
Synonyms:
  • Methyl 4-(acetylamino)-5-chloro-2-hydroxy-3-(2-propen-1-yl)benzoate
  • Benzoic acid, 4-(acetylamino)-5-chloro-2-hydroxy-3-(2-propen-1-yl)-, methyl ester
  • Benzoic acid, 4-(acetylamino)-5-chloro-2-hydroxy-3-(2-propenyl)-, methyl ester
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