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CAS 886362-63-6

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Carbamic acid, [[3-[(4-bromophenyl)amino]phenyl]methyl]-, 1,1-dimethylethyl ester

Description:
Carbamic acid, [[3-[(4-bromophenyl)amino]phenyl]methyl]-, 1,1-dimethylethyl ester, identified by CAS number 886362-63-6, is an organic compound characterized by its carbamate functional group. This substance features a complex structure that includes a bromophenyl moiety, which contributes to its potential biological activity and chemical reactivity. The presence of the dimethylethyl ester group suggests that it may exhibit properties typical of esters, such as volatility and solubility in organic solvents. The compound's molecular structure indicates that it may participate in hydrogen bonding due to the presence of the amine and carbamate functionalities, which could influence its solubility and reactivity in various chemical environments. Additionally, the bromine substituent may impart unique electronic properties, potentially affecting the compound's interaction with biological targets. Overall, this compound's characteristics make it of interest in medicinal chemistry and related fields, where it may serve as a lead compound for further development.
Formula:C18H21BrN2O2
InChI:InChI=1S/C18H21BrN2O2/c1-18(2,3)23-17(22)20-12-13-5-4-6-16(11-13)21-15-9-7-14(19)8-10-15/h4-11,21H,12H2,1-3H3,(H,20,22)
InChI key:InChIKey=KLBUYOMJLPBLBQ-UHFFFAOYSA-N
SMILES:N(C1=CC(CNC(OC(C)(C)C)=O)=CC=C1)C2=CC=C(Br)C=C2
Synonyms:
  • Carbamic acid, [[3-[(4-bromophenyl)amino]phenyl]methyl]-, 1,1-dimethylethyl ester
  • tert-Butyl {3-[(4-bromophenyl)amino]benzyl}carbamate
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