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CAS 939760-49-3

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1,1-Dimethylethyl N-[2-amino-2-(4-chlorophenyl)ethyl]carbamate

Description:
1,1-Dimethylethyl N-[2-amino-2-(4-chlorophenyl)ethyl]carbamate, identified by its CAS number 939760-49-3, is a chemical compound that belongs to the class of carbamates. This substance features a carbamate functional group, which is characterized by the presence of a carbonyl group (C=O) bonded to a nitrogen atom (N) that is also connected to an alkyl or aryl group. The compound contains a tert-butyl group (1,1-dimethylethyl) and an aminoethyl side chain with a para-chlorophenyl substituent, contributing to its potential biological activity. Its structure suggests that it may exhibit properties relevant to medicinal chemistry, possibly acting as an inhibitor or modulator in biological systems. The presence of the chlorophenyl group may enhance lipophilicity, affecting its solubility and permeability. As with many carbamates, it may also be subject to hydrolysis under certain conditions, leading to the release of the corresponding amine and alcohol. Safety and handling precautions are essential, as carbamates can exhibit varying degrees of toxicity.
Formula:C13H19ClN2O2
InChI:InChI=1S/C13H19ClN2O2/c1-13(2,3)18-12(17)16-8-11(15)9-4-6-10(14)7-5-9/h4-7,11H,8,15H2,1-3H3,(H,16,17)
InChI key:InChIKey=DLXYTYBSFHTRKZ-UHFFFAOYSA-N
SMILES:C(CNC(OC(C)(C)C)=O)(N)C1=CC=C(Cl)C=C1
Synonyms:
  • 1,1-Dimethylethyl N-[2-amino-2-(4-chlorophenyl)ethyl]carbamate
  • Carbamic acid, N-[2-amino-2-(4-chlorophenyl)ethyl]-, 1,1-dimethylethyl ester
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