10333-68-3 | 2-(Pyrrol-1-yl)benzoic acid

Packsize	Purity	Availability	Price	Discounted Price
1g	98%	in stock	$57.00	$40.00
5g	98%	in stock	$185.00	$130.00
10g	98%	in stock	$347.00	$243.00
25g	98%	in stock	$758.00	$531.00

Description

• Catalog Number: AD48367
• Chemical Name: 2-(Pyrrol-1-yl)benzoic acid
• CAS Number: 10333-68-3
• Molecular Formula: C11H9NO2
• Molecular Weight: 187.1947
• MDL Number: MFCD00051645
• SMILES: OC(=O)c1ccccc1n1cccc1

Computed Properties

• Complexity: 211
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 14
• Hydrogen Bond Acceptor Count: 2
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 2
• XLogP3: 1.8

Upstream Synthesis Route

2-(1H-Pyrrol-1-yl)benzoic acid is a versatile chemical compound widely used in chemical synthesis as a key building block to create various pharmaceuticals, agrochemicals, and functional materials. Its unique structure containing a pyrrole ring and a benzene ring allows for a wide range of applications in organic chemistry.One of the main uses of 2-(1H-Pyrrol-1-yl)benzoic acid is as a precursor in the synthesis of heterocyclic compounds. By reacting with different reagents and functional groups, it can participate in various chemical transformations such as cyclization reactions to form complex molecular structures with diverse properties. This compound plays a crucial role in the creation of novel drug candidates, herbicides, and materials with specific electronic or optical properties.Moreover, 2-(1H-Pyrrol-1-yl)benzoic acid is utilized in the development of fluorescent dyes and materials due to its potential to exhibit fluorescence properties when appropriately functionalized. This makes it valuable in the design and production of molecular probes, sensors, and imaging agents for various biological and analytical applications.In summary, the application of 2-(1H-Pyrrol-1-yl)benzoic acid in chemical synthesis offers a wide array of possibilities for creating structurally diverse compounds with valuable properties for pharmaceutical, agricultural, and material science purposes.

Literature

• Screening the MayBridge Rule of 3 Fragment Library for Compounds That Interact with the Trypanosoma brucei myo-Inositol-3-Phosphate Synthase and/or Show Trypanocidal Activity.

  Molecular biology international 20110101