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CAS 1020252-75-8

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Phenylmethyl N-(3-bromo-5-nitrophenyl)carbamate

Description:
Phenylmethyl N-(3-bromo-5-nitrophenyl)carbamate, identified by its CAS number 1020252-75-8, is a chemical compound that belongs to the class of carbamates. This substance features a phenylmethyl group attached to a carbamate functional group, which is further substituted with a 3-bromo-5-nitrophenyl moiety. The presence of the bromine and nitro groups indicates that this compound may exhibit significant biological activity, potentially serving as a pharmacophore in medicinal chemistry. The nitro group is known for its electron-withdrawing properties, which can influence the compound's reactivity and solubility. Additionally, the structural characteristics suggest that it may participate in hydrogen bonding due to the carbamate functionality, affecting its physical properties such as melting point and solubility in various solvents. Overall, the unique combination of functional groups in this compound may contribute to its potential applications in research and development, particularly in the fields of pharmaceuticals and agrochemicals.
Formula:C14H11BrN2O4
InChI:InChI=1S/C14H11BrN2O4/c15-11-6-12(8-13(7-11)17(19)20)16-14(18)21-9-10-4-2-1-3-5-10/h1-8H,9H2,(H,16,18)
InChI key:InChIKey=YVVHYVDFMBLQQC-UHFFFAOYSA-N
SMILES:N(C(OCC1=CC=CC=C1)=O)C2=CC(N(=O)=O)=CC(Br)=C2
Synonyms:
  • Carbamic acid, N-(3-bromo-5-nitrophenyl)-, phenylmethyl ester
  • Phenylmethyl N-(3-bromo-5-nitrophenyl)carbamate
  • benzyl N-(3-bromo-5-nitrophenyl)carbamate
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