10241-97-1 | 5-Methylindole-2-carboxylic acid

Packsize	Purity	Availability	Price	Discounted Price
1g	98%	in stock	$15.00	$11.00
5g	98%	in stock	$35.00	$25.00
10g	98%	in stock	$67.00	$47.00

Description

• Catalog Number: AA09380
• Chemical Name: 5-Methylindole-2-carboxylic acid
• CAS Number: 10241-97-1
• Molecular Formula: C10H9NO2
• Molecular Weight: 175.18396
• MDL Number: MFCD00047166
• SMILES: Cc1ccc2c(c1)cc([nH]2)C(=O)O
• NSC Number: 88873

Computed Properties

• Complexity: 217
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 13
• Hydrogen Bond Acceptor Count: 2
• Hydrogen Bond Donor Count: 2
• Rotatable Bond Count: 1
• XLogP3: 2.7

Upstream Synthesis Route

5-Methyl-1H-indole-2-carboxylic acid, also known as $name$, is a versatile compound widely utilized in chemical synthesis. Its unique molecular structure and functional groups make it valuable in several applications within the field.In chemical synthesis, $name$ is commonly employed as a building block for the construction of various organic molecules. Its indole core provides a solid foundation for the formation of more complex structures through derivatization and functionalization reactions. The carboxylic acid group present in $name$ allows for facile modification and coupling with other molecules, enabling the creation of diverse chemical entities.Moreover, the methyl group at the 5-position of the indole ring in $name$ imparts steric effects that can influence the reactivity and selectivity of reactions involving this compound. This feature makes $name$ a valuable tool for controlling regioselectivity and stereochemistry in chemical transformations, leading to the production of desired products with high yields and purity.In summary, the application of 5-Methyl-1H-indole-2-carboxylic acid in chemical synthesis encompasses its role as a key building block for the construction of organic molecules with tailored structures and properties. Its versatility and reactivity make it a valuable asset in the toolbox of synthetic chemists seeking to create novel compounds for various industries and research endeavors.

Literature

• Structure-guided design of alpha-amino acid-derived Pin1 inhibitors.

  Bioorganic & medicinal chemistry letters 20100115

• A chemical screening approach reveals that indole fluorescence is quenched by pre-fibrillar but not fibrillar amyloid-beta.

  Bioorganic & medicinal chemistry letters 20090901

• Non-peptidic small-molecule inhibitors of the single-chain hepatitis C virus NS3 protease/NS4A cofactor complex discovered by structure-based NMR screening.

  Journal of medicinal chemistry 20040506