1199-69-5 | 4-(2-Aminoethyl)benzoic acid

Packsize	Purity	Availability	Price	Discounted Price
250mg	96%	in stock	$89.00	$62.00
1g	96%	in stock	$185.00	$130.00
5g	96%	in stock	$580.00	$406.00
10g	96%	in stock	$797.00	$558.00
25g	96%	in stock	$1,535.00	$1,074.00

Description

• Catalog Number: AA33303
• Chemical Name: 4-(2-Aminoethyl)benzoic acid
• CAS Number: 1199-69-5
• Molecular Formula: C9H11NO2
• Molecular Weight: 165.1891
• MDL Number: MFCD02684184
• SMILES: NCCc1ccc(cc1)C(=O)O

Computed Properties

• Complexity: 151
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 12
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 2
• Rotatable Bond Count: 3
• XLogP3: -0.9

Upstream Synthesis Route

4-(2-Aminoethyl)-Benzoic Acid, also known as anthranilic acid, plays a crucial role in chemical synthesis as a versatile building block with a range of applications. In chemical synthesis, this compound is commonly used as a key intermediate in the preparation of various pharmaceuticals, dyes, and agrochemicals. Its primary amino group allows for functionalization and modification, enabling the synthesis of more complex organic molecules. Additionally, 4-(2-Aminoethyl)-Benzoic Acid can be utilized in the synthesis of heterocyclic compounds, which are important in the development of new materials and bioactive molecules. Its unique structure and reactivity make it a valuable tool in the creation of diverse compounds with potential applications in medicinal chemistry, materials science, and agricultural chemistry.

Literature

• Molecular design of laccase cathode for direct electron transfer in a biofuel cell.

  Biosensors & bioelectronics 20110115

• Arabidopsis GH3.12 (PBS3) conjugates amino acids to 4-substituted benzoates and is inhibited by salicylate.

  The Journal of biological chemistry 20090410

• Design and synthesis of benzoic acid derivatives as influenza neuraminidase inhibitors using structure-based drug design.

  Journal of medicinal chemistry 19971205