3016-39-5

Basic information

• Product Name: (ANILINOCARBONYL)AMINO]ACETIC ACID
• Synonyms: N-(Phenylcarbamoyl)glycine;2-(phenylcarbamoylamino)ethanoic acid;2-(3-Phenylureido)acetic acid
• CAS NO: 3016-39-5
• Molecular Formula: C₉H₁₀N₂O₃
• Molecular Weight: 194.19
• Mol File: 3016-39-5.mol
• Article Data: 12

Chemical Properties

• Boiling Point: 371.2°Cat760mmHg
• Flash Point: 178.3°C
• Appearance: /
• Density: 1.363g/cm³
• Vapor Pressure: 3.63E-06mmHg at 25°C
• Refractive Index: 1.624
• CAS DataBase Reference: (ANILINOCARBONYL)AMINO]ACETIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: (ANILINOCARBONYL)AMINO]ACETIC ACID(3016-39-5)
• EPA Substance Registry System: (ANILINOCARBONYL)AMINO]ACETIC ACID(3016-39-5)

Safety Data

• Hazardous Substances Data: 3016-39-5(Hazardous Substances Data)

Usage

General Description

The chemical compound (ANILINOCARBONYL)AMINO]ACETIC ACID, also known as 3-(anilinocarbonyl)amino]acetic acid, is a derivative of amino acids and contains an aromatic aniline group. It is commonly used as a building block in organic synthesis and pharmaceutical research. (ANILINOCARBONYL)AMINO]ACETIC ACID has the potential to be used in the development of drugs and therapeutics due to its chemical structure and properties. However, it is important to handle this chemical with care as it may be hazardous if not used and stored properly.

InChI:InChI=1/C9H10N2O3/c12-8(13)6-10-9(14)11-7-4-2-1-3-5-7/h1-5H,6H2,(H,12,13)(H2,10,11,14)

Upstream product

• 940-38-5 phenylcarbamoyl azide 
• 56-40-6 glycine 
• 6000-43-7 2-aminoethanoic acid hydrochloride 
• 103-71-9 phenyl isocyanate 
• 65-85-0 benzoic acid 
• 495-18-1 Benzohydroxamic acid 
• 1086764-80-8 C₁₂H₁₀N₂O₅ 
• 623-33-6 glycine ethyl ester hydrochloride 
• 7684-19-7 N-[(phenylamino)carbonyl]glycine ethyl ester 
• 104892-36-6 5-phenyl-hydantoic acid methyl ester 
• 462-60-2 N-carbamoylglycine 
• 4530-20-5 BOC-glycine 
• 107-07-3 2-chloro-ethanol 
• 857818-00-9 N-phenylcarbamoyl-glycyl=>glycyl=>glycine 

Downstream Products

• 104892-36-6 5-phenyl-hydantoic acid methyl ester 
• 2221-13-8 3-phenylimidazolidine-2,4-dione 
• 7684-19-7 N-[(phenylamino)carbonyl]glycine ethyl ester 
• 33557-83-4 1-nitroso-3-phenyl-imidazolidine-2,4-dione 
• 131999-71-8 N-phenylcarbamoyl-glycine hydrazide 
• 131999-73-0 N-phenylcarbamoyl-glycine benzylidenehydrazide 
• 128044-10-0 3-carboxymethyl-1-phenylparabanic acid 
• 860542-33-2 5-phenyl-hydantoic acid anilide 

Relevant articles and documents

Structural elucidation of dendritic host-guest complexes by X-ray crystallography and molecular dynamics simulations

The multiple monovalent binding of adamantyl-urea poly(propyleneimine) dendrimers with carboxylic acid-urea guests was investigated using molecular dynamics simulations and X-ray crystallography to better understand the structure and behavior of the dynam

Ethyl 2-cyano-2-(4-nitrophenylsulfonyloxyimino)acetate-mediated lossen rearrangement: Single-pot racemization-free synthesis of hydroxamic acids and ureas from carboxylic acids

Ethyl 2-cyano-2-(4-nitrophenylsulfonyloxyimino)acetate (4-NBsOXY) mediated Lossen rearrangement and its application for the synthesis of ureas is demonstrated. Required hydroxamic acids for the Lossen rearrangements were synthesized from carboxylic acids using the same reagent. Finally, reaction of an amine with the produced isocyanate resulted in urea. Good yields without racemization were achieved under milder and simpler reaction conditions. Reactions are compatible with common N-protecting groups, such as Boc, Fmoc, Cbz, and benzyl, as well as various OH protecting groups, such as tBu and Bzl. Conversion from carboxylic acid to urea is achieved in one pot. Most importantly, byproducts Oxyma [ethyl 2-cyano-2-(hydroxyimino)acetate] and 4-nitrobenzenesulfonic acid can be recovered easily and can be recycled to prepare the reagent. Thus, the method is environmentally friendly and cost-effective.

Novel malonamide derivatives as potent κ opioid receptor agonists

A novel series of malonamide derivatives was synthesized. These amides were shown to be potent and selective κ opioid receptor agonists.