59253-74-6

Basic information

• Product Name: 1H-Imidazole-5-carboxylic acid, 4-cyano-, ethyl ester
• Synonyms: 1H-Imidazole-5-carboxylic acid, 4-cyano-, ethyl ester;ethyl 4-cyano-1H-imidazole-5-carboxylate
• CAS NO: 59253-74-6
• Molecular Formula: C₇H₇N₃O₂
• Molecular Weight: 165.15
• Mol File: 59253-74-6.mol
• Article Data: 3

Chemical Properties

• Melting Point: 185 °C
• Boiling Point: 447.7±30.0 °C(Predicted)
• Appearance: /
• Density: 1.31±0.1 g/cm3(Predicted)
• PKA: 6.88±0.10(Predicted)
• CAS DataBase Reference: 1H-Imidazole-5-carboxylic acid, 4-cyano-, ethyl ester(CAS DataBase Reference)
• NIST Chemistry Reference: 1H-Imidazole-5-carboxylic acid, 4-cyano-, ethyl ester(59253-74-6)
• EPA Substance Registry System: 1H-Imidazole-5-carboxylic acid, 4-cyano-, ethyl ester(59253-74-6)

Safety Data

• Hazardous Substances Data: 59253-74-6(Hazardous Substances Data)

Usage

Molecular structure

1H-Imidazole-5-carboxylic acid, 4-cyano-, ethyl ester is an organic compound with an imidazole ring, a carboxylic acid group, a cyano group, and an ethyl ester group.

Derivative of imidazole

It is a derivative of imidazole, which is a heterocyclic aromatic organic compound.

Building block in synthesis

It is commonly used as a building block in the synthesis of pharmaceutical compounds, agrochemicals, and other organic products.

Ethyl ester group

The ethyl ester group allows for easy handling and manipulation of the compound in laboratory settings.

Utilized as a reagent

It is utilized as a reagent in organic chemistry reactions, such as esterification and amidation, due to its versatile chemical structure.

Wide range of applications

1H-Imidazole-5-carboxylic acid, 4-cyano-, ethyl ester has a wide range of applications in the field of organic synthesis and is an important intermediate in the production of various chemical products.

Upstream product

• 1122-28-7 4,5-dicyano-1H-imidazole 
• 64-17-5 ethanol 

Downstream Products

• 1345970-09-3 C₃₄H₂₉N₃O₉ 
• 1345970-10-6 C₃₄H₂₉N₃O₉ 
• 155372-92-2 ethyl 4-cyano-1-methyl-1H-imidazole-5-carboxylate 
• 19485-35-9 1-methyl-4,5-dicyanoimidazole 
• 912814-77-8 ethyl 5-cyano-1-[(2'-deoxy-3',5'-di-O-p-toluoyl)-β-D-erythropentofuranosyl]imidazole-4-carboxylate 
• 912814-78-9 ethyl 4-cyano-1-[(2'-deoxy-3',5'-di-O-p-toluoyl)-β-D-erythropentofuranosyl]imidazole-5-carboxylate 
• 1007353-25-4 ethyl 5-cyano-1-(2,3,5-tri-O-benzoyl-β-D-ribofuranosyl)imidazole-4-carboxylate 
• 1007353-23-2 ethyl 4-cyano-1-(2,3,5-tri-O-benzoyl-β-D-ribofuranosyl)imidazole-5-carboxylate 
• 912814-74-5 7-amino-1-(2'-deoxy-β-D-erythropentofuranosyl)-1H-imidazo[4,5-d]pyridazin-4(5H)-one 
• 912814-75-6 4-amino-1-(2'-deoxy-β-D-erythropentofuranosyl)-3H-imidazo[4,5-d]pyridazin-7(6H)-one 

Relevant articles and documents

NOVEL INDAZOLE COMPOUND OR SALT THEREOF

An indazole compound represented by the following Formula (I) or a salt thereof: wherein X, R1, R2, ring A, L1, L2, L3, and R5 are as defined in this specification.

Synthesis and Assignments of Regioisomeric Cyanoimidazole Esters

Regioassignments of ethyl cyanoimidazolecarboxylates have been performed by the nuclear Overhauser effect(NOE) studies on the regioisomeric monocyanoimidazoles obtained by the hydrolysis of the esters followed by decarboxylation.Alternately, regioassignment could also be carried out by comparing the chemical shifts of the N-methyl groups.