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CAS 10477-72-2

:

4-[Bis(2-chloroethyl)amino]benzeneacetic acid

Description:
4-[Bis(2-chloroethyl)amino]benzeneacetic acid, with the CAS number 10477-72-2, is a chemical compound that features a benzene ring substituted with a bis(2-chloroethyl)amino group and an acetic acid moiety. This compound is characterized by its potential use in medicinal chemistry, particularly in the development of anticancer agents due to its alkylating properties. The presence of the chloroethyl groups allows for the formation of reactive intermediates that can interact with nucleophilic sites in biological molecules, such as DNA. The carboxylic acid functional group contributes to its solubility in polar solvents and may influence its biological activity. Additionally, the compound's structure suggests it may exhibit both lipophilic and hydrophilic characteristics, which can affect its pharmacokinetics and bioavailability. Safety and handling precautions are essential due to the presence of chlorine atoms, which can pose health risks. Overall, this compound is of interest in the field of pharmaceutical research, particularly for its potential therapeutic applications.
Formula:C12H15Cl2NO2
InChI:InChI=1S/C12H15Cl2NO2/c13-5-7-15(8-6-14)11-3-1-10(2-4-11)9-12(16)17/h1-4H,5-9H2,(H,16,17)
InChI key:InChIKey=RQAFMLCWWGDNLI-UHFFFAOYSA-N
SMILES:N(CCCl)(CCCl)C1=CC=C(CC(O)=O)C=C1
Synonyms:
  • (4-(Bis(2-chloroethyl)amino)phenyl)acetic acid
  • (p-(Bis(2-chloroethyl)amino)phenyl)acetic acid
  • 1-(2-Chlorophenyl)Ethanone
  • 2-(p-(Bis(2-chloroethyl)amino)phenyl)acetic acid
  • 4-(Bis(2-chloroethyl)amino)benzeneacetic acid
  • 4-[N,N-Bis(2-chloroethyl)amino]phenylacetic acid
  • Acetic acid, (p-(bis(2-chloroethyl)amino)phenyl)-
  • Acetic acid, (p-(bis(2-chloroethyl)amino)phenyl)- (8CI)
  • Acetic acid, 2-(p-(bis(2-chloroethyl)amino)phenyl)-
  • Benzeneacetic acid, 4-(bis(2-chloroethyl)amino)- (9CI)
  • See more synonyms
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