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CAS 956576-40-2

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1,4-Dimethyl 2-[(2-chloro-1-oxopropyl)amino]-1,4-benzenedicarboxylate

Description:
1,4-Dimethyl 2-[(2-chloro-1-oxopropyl)amino]-1,4-benzenedicarboxylate, with the CAS number 956576-40-2, is a synthetic organic compound characterized by its complex structure, which includes a benzene ring substituted with two methyl groups and two carboxylate groups, along with an amino group linked to a chloro-substituted propanoyl moiety. This compound is likely to exhibit properties typical of both aromatic and aliphatic systems, including potential solubility in organic solvents and moderate stability under standard conditions. The presence of the chloro and amino functional groups suggests that it may participate in various chemical reactions, such as nucleophilic substitutions or coupling reactions. Additionally, the compound may possess biological activity, making it of interest in medicinal chemistry or pharmacology. Its specific applications and reactivity would depend on the context of its use, including potential roles in drug development or as an intermediate in organic synthesis. Safety and handling precautions should be observed due to the presence of chlorine and other reactive functional groups.
Formula:C13H14ClNO5
InChI:InChI=1S/C13H14ClNO5/c1-7(14)11(16)15-10-6-8(12(17)19-2)4-5-9(10)13(18)20-3/h4-7H,1-3H3,(H,15,16)
InChI key:InChIKey=MFEMBWXBVABUFJ-UHFFFAOYSA-N
SMILES:N(C(C(C)Cl)=O)C1=C(C(OC)=O)C=CC(C(OC)=O)=C1
Synonyms:
  • 1,4-Dimethyl 2-[(2-chloro-1-oxopropyl)amino]-1,4-benzenedicarboxylate
  • 1,4-Benzenedicarboxylic acid, 2-[(2-chloro-1-oxopropyl)amino]-, 1,4-dimethyl ester
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