5097-99-4

Basic information

• Product Name: Phenyl(diethylamino)acetonitrile
• Synonyms: 2-(Diethylamino)-2-phenylacetonitrile;Phenyl(diethylamino)acetonitrile;α-(Diethylamino)benzeneacetonitrile;alpha-(Diethylamino)phenylacetonitrile
• CAS NO: 5097-99-4
• Molecular Formula: C₁₂H₁₆N₂
• Molecular Weight: 188.27
• Mol File: 5097-99-4.mol
• Article Data: 15

Chemical Properties

• Boiling Point: 274.6°C at 760 mmHg
• Flash Point: 105.2°C
• Appearance: /
• Density: 0.992g/cm³
• Vapor Pressure: 0.00535mmHg at 25°C
• Refractive Index: 1.523
• PKA: 5.75±0.25(Predicted)
• CAS DataBase Reference: Phenyl(diethylamino)acetonitrile(CAS DataBase Reference)
• NIST Chemistry Reference: Phenyl(diethylamino)acetonitrile(5097-99-4)
• EPA Substance Registry System: Phenyl(diethylamino)acetonitrile(5097-99-4)

Safety Data

• Hazardous Substances Data: 5097-99-4(Hazardous Substances Data)

Usage

Synthesis Reference(s)

Journal of the American Chemical Society, 72, p. 358, 1950 DOI: 10.1021/ja01157a097

InChI:InChI=1/C12H16N2/c1-3-14(4-2)12(10-13)11-8-6-5-7-9-11/h5-9,12H,3-4H2,1-2H3

Upstream product

• 65459-13-4 bis(diethylamino)cyanoborane 
• 100-52-7 benzaldehyde 
• 7677-24-9 trimethylsilyl cyanide 
• 109-89-7 diethylamine 
• 58046-15-4 O-(Diphenylphosphinoyl)-benzaldehyd-cyanhydrin 
• 143-33-9 sodium cyanide 
• 660-68-4 diethyl amine hydrochloride 
• 827-36-1 2-(N,N-dimethylamino)-2-phenylacetonitrile 
• 75-86-5 2-hydroxy-2-methylpropanenitrile 
• 151-50-8 potassium cyanide 
• 4657-12-9 sodium hydroxy(phenyl)methanesulfonate 
• 532-28-5 (RS)-mandelonitrile 
• 617-84-5 N-formyldiethylamine 
• 100-58-3 phenylmagnesium bromide 

Downstream Products

• 495-71-6 phenacylacetophenone 
• 800-13-5 N,N,N',N'-tetraethyl-1,2-diphenylethane-1,2-diamine 
• 772-54-3 N,N-diethylbenzylamine 
• 128072-08-2 (1Z,3Z)-N,N,N',N'-Tetraethyl-1,4-diphenyl-buta-1,3-diene-1,4-diamine 
• 123839-86-1 N-ethyl-N-(phenyl(pyridin-2-yl)methyl)ethanamine 
• 85356-10-1 2,5-Bis(diethylamino)-2,5-diphenyladiponitrile 
• 1696-17-9 N,N-diethylbenzamide 
• 107627-47-4 α-Cyclohexyl-benzyl-diaethylamin 
• 64049-87-2 diethyl-(cyano-phenyl-methyl)-methyl-ammonium; iodide 
• 611-71-2 MANDELIC ACID 
• 109-89-7 diethylamine 
• 732938-75-9 2-diethylamino-2-phenylacetamide 
• 31788-97-3 N¹,N¹-diethyl-1-phenyl-1,2-ethanediamine 
• 64857-61-0 diethyl-bibenzyl-α-yl-amine 

Relevant articles and documents

One-Pot Synthesis of α-Amino Nitrile Units through Alkylative Strecker Cyanation from Formamides

In this work, we describe the one-pot synthesis of α-amino nitrile units by the concomitant addition of alkyl (or aryl) Grignard reagents and TMS cyanide through alkylative Strecker cyanation from readily available formamides. The reaction is broad in sco

Synthesis of α-amino nitriles through Strecker-type reaction using SO3H -functionalized ionic liquid as a homogeneous and water tolerant-acidic catalyst

Task-specific ionic liquid (TSIL) bearing a sulfonic acid group in imidazolium cation (10 mol %), was found to be an effective catalyst for a Strecker-type reaction in water at room temperature. A wide variety of aldehydes/ketones, amines and TMSCN as cya

Oxalic acid as a simple and efficient organocatalyst for three-component synthesis of α-amino nitriles

A simple, efficient, and general method has been developed for the synthesis of α-amino nitriles. Oxalic acid as a Br?nsted acid promotes the addition of TMSCN to various imines (generated in situ).