117657-40-6 | 1-(tert-Butoxycarbonyl)-1h-pyrrole-2-carboxylic acid

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Description

• Catalog Number: AE25602
• Chemical Name: 1-(tert-Butoxycarbonyl)-1h-pyrrole-2-carboxylic acid
• CAS Number: 117657-40-6
• Molecular Formula: C10H13NO4
• Molecular Weight: 211.2145
• MDL Number: MFCD02094480
• SMILES: OC(=O)c1cccn1C(=O)OC(C)(C)C

Computed Properties

• Complexity: 269
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 15
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 3
• XLogP3: 1.8

Upstream Synthesis Route

1-(tert-Butoxycarbonyl)-1H-pyrrole-2-carboxylic acid, also known as $name$, is a versatile compound widely used in chemical synthesis. This compound plays a crucial role as a building block in the synthesis of complex organic molecules. Its unique structure and reactivity make it a valuable tool for organic chemists in the creation of various pharmaceuticals, agrochemicals, and materials.In chemical synthesis, 1-(tert-Butoxycarbonyl)-1H-pyrrole-2-carboxylic acid acts as a key intermediate for the preparation of heterocyclic compounds, which are essential components in drug discovery and development. By selectively modifying its functional groups, chemists can tailor the molecular structure of the final product to achieve specific properties or biological activities.Moreover, this compound's stability and compatibility with a wide range of reaction conditions make it an ideal choice for building diverse molecular scaffolds. Whether it is used for constructing complex natural products or designing novel organic materials, the versatility of 1-(tert-Butoxycarbonyl)-1H-pyrrole-2-carboxylic acid makes it an indispensable tool in modern organic synthesis strategies.