1193-62-0 | Methyl 1H-pyrrole-2-carboxylate

Packsize	Purity	Availability	Price	Discounted Price
1g	98%	in stock	$14.00	$10.00
10g	98%	in stock	$15.00	$10.00
25g	98%	in stock	$25.00	$18.00
100g	98%	in stock	$90.00	$63.00

Description

• Catalog Number: AA23850
• Chemical Name: Methyl 1H-pyrrole-2-carboxylate
• CAS Number: 1193-62-0
• Molecular Formula: C6H7NO2
• Molecular Weight: 125.12528000000002
• MDL Number: MFCD00817048
• SMILES: COC(=O)c1ccc[nH]1
• NSC Number: 48131

Computed Properties

• Complexity: 114
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 9
• Hydrogen Bond Acceptor Count: 2
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 2
• XLogP3: 1.2

Upstream Synthesis Route

Methyl 1H-pyrrole-2-carboxylate is a versatile compound that finds extensive use in chemical synthesis. It serves as a key building block in the creation of various complex organic molecules due to its unique structural properties and reactivity. In the realm of chemical synthesis, Methyl 1H-pyrrole-2-carboxylate acts as a crucial intermediate for the preparation of pharmaceuticals, agrochemicals, and materials. Its ability to undergo diverse chemical transformations, such as condensation reactions, functional group modifications, and ring-opening processes, makes it a valuable tool for synthesizing a wide range of compounds with specific functionalities and structural motifs. Additionally, the presence of the pyrrole ring in Methyl 1H-pyrrole-2-carboxylate imparts desirable properties to the final products, making it a sought-after precursor in the field of organic synthesis.

Literature

• Methyl 1H-pyrrole-2-carboxyl-ate.

  Acta crystallographica. Section E, Structure reports online 20090901

• Catalytic asymmetric hydrogenation of 2,3,5-trisubstituted pyrroles.

  Journal of the American Chemical Society 20080123

• A novel synthesis of arylpyrrolo[1,2-a]pyrazinone derivatives.

  Molecules (Basel, Switzerland) 20040630

• Vibrational spectrum of methyl pyrrole-2-carboxylate.

  Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20020101

• Dimethyl 2-[[2-(methoxycarbonyl)-1-(methoxycarbonylmethyl)pyrrol-4-yl]methylene]propanedioate.

  Acta crystallographica. Section C, Crystal structure communications 20010801