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Updated: May 3, 2026

Preparation and In Vivo Use of an Activity-based Probe for N-acylethanolamine Acid Amidase
Published on: November 23, 2016
2-(6-Hy-droxy-1-benzo-furan-3-yl)acetamide
D B Arunakumar1, G Krishnaswamy1, S Sreenivasa1
1Department of Studies and Research in Chemistry, Tumkur University, Tumkur, Karnataka 572 103, India.
Structural analysis of a novel organic compound reveals a near-perpendicular arrangement between its benzofuran core and acylamide group. Molecular interactions in the crystal structure include hydrogen bonds forming sheet-like networks.
Area of Science:
- Crystallography
- Organic Chemistry
- Materials Science
Background:
- Understanding the three-dimensional structure of organic molecules is crucial for predicting their properties and designing new materials.
- Benzofuran derivatives are prevalent in pharmaceuticals and organic electronics.
Purpose of the Study:
- To elucidate the crystal structure and intermolecular interactions of a specific benzofuran derivative (C10H9NO3).
- To provide detailed structural information for potential applications in materials science.
Main Methods:
- Single-crystal X-ray diffraction was employed to determine the molecular and crystal structure.
- Analysis of hydrogen bonding networks and dihedral angles was performed.
Main Results:
- The crystal structure of C10H9NO3 was determined, showing a dihedral angle of 83.76° between the benzofuran system and the -C-C(O)-N- segment.
- N-H⋯O and O-H⋯O hydrogen bonds were identified, leading to the formation of (001) sheets with specific chain motifs (C(4) and C(10)).
Conclusions:
- The study provides precise crystallographic data for C10H9NO3.
- The observed hydrogen bonding patterns suggest potential for self-assembly and supramolecular chemistry applications.
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