1011-65-0 | Methyl indole-5-carboxylate

Packsize	Purity	Availability	Price	Discounted Price
1g	98%	in stock	$12.00	$9.00
5g	98%	in stock	$21.00	$15.00
10g	98%	in stock	$29.00	$21.00
25g	98%	in stock	$65.00	$46.00
100g	98%	in stock	$259.00	$182.00

Description

• Catalog Number: AA04677
• Chemical Name: Methyl indole-5-carboxylate
• CAS Number: 1011-65-0
• Molecular Formula: C10H9NO2
• Molecular Weight: 175.184
• MDL Number: MFCD00153023
• SMILES: COC(=O)c1ccc2c(c1)cc[nH]2

Computed Properties

• Complexity: 205
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 13
• Hydrogen Bond Acceptor Count: 2
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 2
• XLogP3: 2.6

Upstream Synthesis Route

The application of Methyl 1H-indole-5-carboxylate in chemical synthesis lies in its role as a versatile building block for the preparation of various indole-based compounds. With its conjugated structure and functional groups, Methyl 1H-indole-5-carboxylate serves as a key intermediate in the synthesis of pharmaceuticals, agrochemicals, and other organic compounds. Through strategic functional group manipulations and transformations, chemists can utilize Methyl 1H-indole-5-carboxylate to access a diverse array of final products with tailored properties and functionalities. Its presence in the chemical synthesis toolbox enables the creation of intricate molecular structures, making it a valuable asset in the quest for novel compounds and materials.

Literature

• Microsphere-based protease assays and screening application for lethal factor and factor Xa.

  Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

• Generation of new protein kinase inhibitors utilizing cytochrome p450 mutant enzymes for indigoid synthesis.

  Journal of medicinal chemistry 20040603