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CAS 125483-57-0

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Cyclobutanecarboxylic acid, 1-amino-, phenylmethyl ester, 4-methylbenzenesulfonate

Description:
Cyclobutanecarboxylic acid, 1-amino-, phenylmethyl ester, 4-methylbenzenesulfonate, with CAS number 125483-57-0, is a chemical compound characterized by its complex structure, which includes a cyclobutane ring, a carboxylic acid functional group, an amino group, and a phenylmethyl ester moiety. This compound is likely to exhibit both hydrophilic and hydrophobic properties due to the presence of polar functional groups (carboxylic acid and amino) and nonpolar aromatic groups (phenyl and methylbenzene sulfonate). The sulfonate group enhances its solubility in water and may contribute to its reactivity and interaction with biological systems. The presence of the cyclobutane ring suggests potential strain, which can influence its reactivity and stability. This compound may be of interest in medicinal chemistry and materials science due to its unique structural features, which could impart specific biological activities or physical properties. However, detailed studies would be necessary to fully understand its behavior, potential applications, and safety profile.
Formula:C12H15NO2·C7H8O3S
InChI:InChI=1S/C12H15NO2.C7H8O3S/c13-12(7-4-8-12)11(14)15-9-10-5-2-1-3-6-10;1-6-2-4-7(5-3-6)11(8,9)10/h1-3,5-6H,4,7-9,13H2;2-5H,1H3,(H,8,9,10)
InChI key:InChIKey=VMURDJGCQYSKKE-UHFFFAOYSA-N
SMILES:C(OCC1=CC=CC=C1)(=O)C2(N)CCC2.S(=O)(=O)(O)C1=CC=C(C)C=C1
Synonyms:
  • 1-Aminocyclobutane-1-carboxylic acid benzyl ester tosylate
  • Cyclobutanecarboxylic acid, 1-amino-, phenylmethyl ester, 4-methylbenzenesulfonate
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