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CAS 180863-55-2

:

Methyl 3-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]benzoate

Description:
Methyl 3-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]benzoate, with the CAS number 180863-55-2, is an organic compound characterized by its complex structure, which includes a benzoate moiety and an amino group. This compound features a methyl ester functional group, which contributes to its solubility in organic solvents and its reactivity in various chemical reactions. The presence of the 1,1-dimethylethoxycarbonyl group indicates that it has protective characteristics, often used in synthetic chemistry to shield reactive amine functionalities. The compound is likely to exhibit moderate stability under standard conditions but may be sensitive to hydrolysis, particularly in the presence of strong acids or bases. Its molecular structure suggests potential applications in medicinal chemistry, particularly in the development of pharmaceuticals or agrochemicals, where modifications to the amino and ester groups can lead to diverse biological activities. As with many organic compounds, proper handling and storage are essential to maintain its integrity and prevent degradation.
Formula:C14H19NO4
InChI:InChI=1S/C14H19NO4/c1-14(2,3)19-13(17)15-9-10-6-5-7-11(8-10)12(16)18-4/h5-8H,9H2,1-4H3,(H,15,17)
InChI key:InChIKey=YBEKNOSAAIRRRW-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1=CC(CNC(OC(C)(C)C)=O)=CC=C1
Synonyms:
  • Methyl 3-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]benzoate
  • Benzoic acid, 3-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]-, methyl ester
  • 3-[[(tert-Butoxycarbonyl)amino]methyl]benzoic acid methyl ester
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