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CAS 500013-39-8

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1,1-Dimethylethyl 4-[[3-(hydroxymethyl)phenyl]methyl]-1-piperazinecarboxylate

Description:
1,1-Dimethylethyl 4-[[3-(hydroxymethyl)phenyl]methyl]-1-piperazinecarboxylate, identified by its CAS number 500013-39-8, is a chemical compound characterized by its complex structure, which includes a piperazine ring and a hydroxymethyl-substituted phenyl group. This compound typically exhibits properties associated with both amines and esters due to the presence of the piperazine and carboxylate functionalities. It is likely to be a white to off-white solid or a viscous liquid, depending on its purity and specific formulation. The presence of the dimethyl group contributes to its steric hindrance, which can influence its reactivity and interaction with biological systems. This compound may have applications in pharmaceuticals or as a research chemical, particularly in studies involving receptor interactions or as a potential therapeutic agent. Its solubility characteristics would depend on the solvent used, with polar solvents likely enhancing solubility due to the presence of hydroxyl and amine groups. Safety data should be consulted for handling and potential hazards associated with this compound.
Formula:C17H26N2O3
InChI:InChI=1/C17H26N2O3/c1-17(2,3)22-16(21)19-9-7-18(8-10-19)12-14-5-4-6-15(11-14)13-20/h4-6,11,20H,7-10,12-13H2,1-3H3
InChI key:InChIKey=SVXAVOKCPICEEL-UHFFFAOYSA-N
SMILES:C(C1=CC(CO)=CC=C1)N2CCN(C(OC(C)(C)C)=O)CC2
Synonyms:
  • 1,1-Dimethylethyl 4-[[3-(hydroxymethyl)phenyl]methyl]-1-piperazinecarboxylate
  • 1-Piperazinecarboxylic acid, 4-[[3-(hydroxymethyl)phenyl]methyl]-, 1,1-dimethylethyl ester
  • tert-butyl 4-[3-(hydroxymethyl)benzyl]tetrahydro-1(2H)-pyrazinecarboxylate
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