31722-49-3

Basic information

• Product Name: 1H-IMIDAZOLE-2-CARBONITRILE
• Synonyms: 1H-IMIDAZOLE-2-CARBONITRILE;1H-Imidazole-2-carbonitri...;1H-Imidazol-2-carbonitrile;2-Cyanoimidazole;2CNZ
• CAS NO: 31722-49-3
• Molecular Formula: C₄H₃N₃
• Molecular Weight: 93.08672
• Product Categories: pharmacetical
• Mol File: 31722-49-3.mol
• Article Data: 9

Chemical Properties

• Melting Point: 176-177 °C(Solv: benzene (71-43-2))
• Boiling Point: 276 °C at 760 mmHg
• Flash Point: 103.7 °C
• Appearance: /
• Density: 1.28 g/cm³
• Vapor Pressure: 0.00493mmHg at 25°C
• Refractive Index: 1.551
• Storage Temp.: Sealed in dry,Room Temperature
• PKA: 9.51±0.10(Predicted)
• CAS DataBase Reference: 1H-IMIDAZOLE-2-CARBONITRILE(CAS DataBase Reference)
• NIST Chemistry Reference: 1H-IMIDAZOLE-2-CARBONITRILE(31722-49-3)
• EPA Substance Registry System: 1H-IMIDAZOLE-2-CARBONITRILE(31722-49-3)

Safety Data

• Hazardous Substances Data: 31722-49-3(Hazardous Substances Data)

Usage

General Description

1H-Imidazole-2-carbonitrile is a chemical compound with the molecular formula C4H3N3. It is a heterocyclic organic compound with a five-membered ring structure containing three carbon atoms and two nitrogen atoms. 1H-Imidazole-2-carbonitrile is used in the synthesis of pharmaceuticals and agrochemicals as an important intermediate. It is also used as a building block in the production of various fine chemicals and active pharmaceutical ingredients. 1H-Imidazole-2-carbonitrile has potential applications in the development of novel drugs and therapeutic compounds due to its unique chemical structure and reactivity. As such, it is a valuable and versatile compound in the field of organic chemistry and drug discovery.

InChI:InChI=1/C4H3N3/c5-3-4-6-1-2-7-4/h1-2H,(H,6,7)

Upstream product

• 10111-08-7 2-imidazolecarbaldehyde 
• 16093-82-6 1H-Imidazole-2-carbothioic acid amide 
• 101226-40-8 1-<<2-(trimethylsilyl)ethoxy>methyl>-1H-imidazole-2-carbonitrile 
• 46323-27-7 1-(Phenylmethyl)-1H-imidazole-2-carbonitrile 

Downstream Products

• 46323-27-7 1-(Phenylmethyl)-1H-imidazole-2-carbonitrile 
• 1604817-73-3 (2R,5S)-5-(2-cyanoimidazol-1-ylmethyl)-4-{2-[6-(4-fluorobenzyl)-3,3-dimethyl-2,3-dihydro-pyrrolo[3,2-b]pyridin-1-yl]-2-oxo-ethyl}-2-methyl-piperazine-1-carboxylic acid tert-butyl ester 
• 1434585-12-2 C₁₅H₁₃N₇O 
• 1383742-21-9 t-butyl (R)-(2-(5-bromo-2-fluorophenyl)-1-(2-cyano-1H-imidazol-1-yl)propan-2-yl)carbamate 
• 1185190-24-2 1-[4-(3,5-dimethylphenylsulfanyl)-5-iodo-2-methyl-6-oxo-1,6-dihydropyridin-3-ylmethyl]-1H-imidazole-2-carbonitrile 
• 53981-69-4 1-(1H-imidazol-2-yl)ethanone 

Relevant articles and documents

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Discovery of (S)-4-isobutyloxazolidin-2-one as a novel leucyl-tRNA synthetase (LRS)-targeted mTORC1 inhibitor

A series of leucinol analogs were investigated as leucyl-tRNA synthetase-targeted mTORC1 inhibitors. Among them, compound 5, (S)-4-isobutyloxazolidin-2-one, showed the most potent inhibition on the mTORC1 pathway in a concentration-dependent manner. Compound 5 inhibited downstream phosphorylation of mTORC1 by blocking leucine-sensing ability of LRS, without affecting the catalytic activity of LRS. In addition, compound 5 exhibited cytotoxicity against rapamycin-resistant colon cancer cells, suggesting that LRS has the potential to serve as a novel therapeutic target.

Acetohydroxamic acid: A new reagent for efficient synthesis of nitriles directly from aldehydes using Bi(OTf)3 as the catalyst

An efficient method for the preparation of nitriles directly from aldehydes by reaction with AHA using Bi(OTf)3 as the catalyst is described. Bi(OTf)3 is shown to be an efficient catalyst also for the conversion of aldoximes into nitriles.