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3-[BENZYL-(2-CYANO-ETHYL)-AMINO]-PROPIONITRILE, with the molecular formula C15H16N2, is a propionitrile derivative that features a benzyl group and a 2-cyano-ethyl-amino group. This chemical compound is recognized for its versatility and potential applications across various fields, making it a valuable building block in the chemical industry.
Used in Pharmaceutical Research:
3-[BENZYL-(2-CYANO-ETHYL)-AMINO]-PROPIONITRILE is used as a starting material for the preparation of various drugs and biologically active molecules. Its unique structure allows for the development of new pharmaceutical compounds with potential therapeutic applications.
Used in Organic Synthesis:
In the realm of organic synthesis, 3-[BENZYL-(2-CYANO-ETHYL)-AMINO]-PROPIONITRILE serves as a key intermediate, facilitating the creation of a wide range of chemical products through its reactive functional groups.
Used in Chemical Intermediates Production:
3-[BENZYL-(2-CYANO-ETHYL)-AMINO]-PROPIONITRILE is utilized in the production of dyes, pigments, and other chemical intermediates, contributing to the coloration and enhancement of various products in different industries.
Used in Dye and Pigment Industries:
3-[BENZYL-(2-CYANO-ETHYL)-AMINO]-PROPIONITRILE is used as a chemical intermediate for the development of dyes and pigments, providing a foundation for the creation of vibrant colors and shades in textiles, paints, and other applications.

782-87-6

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782-87-6 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 782-87-6 includes 6 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 3 digits, 7,8 and 2 respectively; the second part has 2 digits, 8 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 782-87:
(5*7)+(4*8)+(3*2)+(2*8)+(1*7)=96
96 % 10 = 6
So 782-87-6 is a valid CAS Registry Number.

782-87-6SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 13, 2017

Revision Date: Aug 13, 2017

1.Identification

1.1 GHS Product identifier

Product name 3,3'-(Benzylimino)dipropanenitrile

1.2 Other means of identification

Product number -
Other names N,N-bis(2-cyanoethyl) benzylamine

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:782-87-6 SDS

782-87-6Relevant academic research and scientific papers

Green synthesis of Ag@Au bimetallic regenerated cellulose nanofibers for catalytic applications

Gopiraman, Mayakrishnan,Saravanamoorthy, Somasundaram,Baskar, Ramaganthan,Ilangovan, Andivelu,Ill-Min, Chung

, p. 17090 - 17103 (2019/11/14)

The green synthesis of nanocomposites has attracted huge consideration in recent years due to its positive environmentally friendly impact. The present study reports the first bimetallic Ag-Au cellulose nanofiber composite (Ag@Au/CNCs) prepared via a very simple green preparation method. An aqueous leaves extract of Moringa oleifera was used to obtain the bimetallic Ag@Au/CNC nanocomposite. High-resolution transmission electron microscopy (HRTEM) observations revealed the successful formation of triangle, hexagonal, and spherical shapes of well-combined Ag-Au nanoparticles on the regenerated cellulose nanofiber surface. Further, the formation of Au-Ag bimetallic nanostructures was confirmed by X-ray photoelectron spectroscopy (XPS) and X-ray crystallography (XRD) results. The resultant bimetallic Ag@Au/CNC catalyst was found to perform remarkably well in the reduction of nitrophenols. The bimetallic Ag@Au/CNC catalyst gave excellent kapp values of 15.59 and 22.83 × 10-3 s-1 for the 2- A nd 4-nitrophenol reduction process, respectively. To our delight, the Ag@Au/CNC catalyst was found to perform well in the aza-Michael reaction. The catalytic activity of Ag@Au/CNCs was compared with mono-metallic Ag/CNCs, Au/CNCs, and other reported catalysts. Based on the results obtained, the high synergy of Ag@Au/CNCs was explained. A possible mechanism is proposed for the Ag@Au/CNC-catalyzed nitrophenol reduction and aza-Michael reactions.

Cultivation of a Cu/HMPC catalyst from a hyperaccumulating mustard plant for highly efficient and selective coupling reactions under mild conditions

Gopiraman, Mayakrishnan,Wei, Kai,Zhang, Ke-Qin,Chung, Ill-Min,Kim, Ick Soo

, p. 4531 - 4547 (2018/02/09)

Cu-containing activated carbon (eco-catalyst, Cu/HMPC, where 'C' defines 'carbon') was derived from a metal-hyperaccumulating mustard plant (HMP) by a simple chemical activation method. Transmission electron microscopy/selected area diffraction (HRTEM/SAED) results revealed that the Cu/HMPC has mainly three types of morphology [sheet-like morphology (2D), hollow-spheres (3D) and needle-like structures (1D)] which are interconnected. HRTEM-SAED, Raman and X-ray photoelectron spectroscopy (XPS) results confirmed the existence of Cu oxide species in Cu/HMPC. Content of Cu in Cu/HMPC was determined to be 1.03 wt%. The quality of graphitization in Cu/HMPC was discussed by using Raman and XRD results. The BET surface area of Cu/HMPC was determined to be 620.8 m2 g-1. The Cu/HMPC actively transformed a wide range of amines to imines under very mild reaction conditions. The catalyst Cu/HMPC gave products in excellent yields (98-61%) with very high TON/TOF values (1512/339-833/35 h-1). To the best of our knowledge, this is the most efficient Cu-based heterogeneous eco-catalyst for the synthesis of imines among those reported to date. The Cu can be recovered from used Cu/HMPC by a simple HCl treatment. Versatility, heterogeneity and reusability of Cu/HMPC were tested. A possible mechanism has been proposed.

3-PHOSPHOGLYCERATE DEHYDROGENASE INHIBITORS AND USES THEREOF

-

, (2017/09/27)

The present invention provides compounds, compositions thereof, and methods of using the same.

Unsymmetrical cyclotriazadisulfonamide (CADA) compounds as human CD4 receptor down-modulating agents

Demillo, Violeta G.,Goulinet-Mateo, Florian,Kim, Jessica,Schols, Dominique,Vermeire, Kurt,Bell, Thomas W.

scheme or table, p. 5712 - 5721 (2011/10/08)

Cyclotriazadisulfonamide (CADA) inhibits HIV at submicromolar levels by specifically down-modulating cell-surface and intracellular CD4. The specific biomolecular target of CADA compounds is unknown, but previous studies led to an unsymmetrical binding model. To test this model, methods were developed for effective synthesis of diverse, unsymmetrical CADA compounds. A total of 13 new, unsymmetrical target compounds were synthesized, as well as one symmetrical analogue. The new compounds display a wide range of potency for CD4 down-modulation in CHO-CD4-YFP cells. VGD020 (IC50 = 46 nM) is the most potent CADA compound discovered to date, and VGD029 (IC50 = 730 nM) is the most potent fluorescent analogue. Structure-activity relationships are analyzed from the standpoint of additive or nonadditive energy effects of different substituents. They appear to be consistent with the zipper-type mechanism in which entropy costs are reduced for additional stabilizing interactions between the small molecule and its protein target.

Convergent synthesis of polynitrile and/or polyamine dendrimers through hydroaminomethylation and Michael addition

Beigi, Maryam,Ricken, Stefan,Mueller, Kai Sven,Koc, Fikret,Eilbracht, Peter

supporting information; experimental part, p. 1482 - 1492 (2011/04/22)

A general concept for a versatile convergent synthesis ofpolynitrile and/or polyamine dendrimers has been developed by applying Voegtle's procedure in combination with thetandem hydroformylation/reductive amination sequence, known as hydroaminomethylation

Synthesis of dendritic tryptophan derivatives and investigation on dendritic effects of their fluorescence and reactivity

He, Dongsheng,He, Gu,Guo, Li

scheme or table, p. 454 - 460 (2012/04/10)

Two series of dendritic tryptophan derivatives have been synthesized and characterized, their emission spectra in different solvents and the reactivity of tryptophan were investigated and compared. There was a progressive shielding effect of the tryptophan in the emissive wavelengths of dendrimers increased with the size or generation of the dendritic shell.

An effective aza-michael addition of aromatic amines to electron-deficient alkenes in alkaline Al2O3

Ai, Xin,Wang, Xin,Liu, Jin-Ming,Ge, Ze-Mei,Cheng, Tie-Ming,Li, Run-Tao

experimental part, p. 5373 - 5377 (2010/08/06)

Aza-Michael addition of aromatic or aliphatic amines with various electron-deficient alkenes was performed using alkaline Al2O 3 as solid media at room temperature afforded the corresponding Michael addition products in good to excellent yields.The alkaline Al 2O3 can be easily recovered and reused.

Aqueous aza-michael reaction of conjugated alkenes: Toward spermine

Joshi, Jigar H.,Saiyed, Akeel S.,Bedekar, Ashutosh V.

experimental part, p. 2857 - 2863 (2010/11/18)

An aqueous aza-Michael reaction is efficiently achieved with excellent conversions without any additives. The method works very well on a molar scale with selectively for aliphatic amines. An intermediate for spermine is also made by this green process.

POLYAMINE DERIVATIVE AND POLYOL DERIVATIVE

-

Page/Page column 33, (2008/06/13)

A novel polyamine derivative, or polyol derivative, having a piperidylaminotriazine skeleton, salts of such compounds, a process for producing them, an organic material stabilizer comprising any of such compounds, a method of stabilizing an organic materi

Synthesis and structure-activity relationship studies of CD4 down-modulating cyclotriazadisulfonamide (CADA) analogues

Bell, Thomas W.,Anugu, Sreenivasa,Bailey, Patrick,Catalano, Vincent J.,Dey, Kaka,Drew, Michael G. B.,Duffy, Noah H.,Jin, Qi,Samala, Meinrado F.,Sodoma, Andrej,Welch, William H.,Schols, Dominique,Vermeire, Kurt

, p. 1291 - 1312 (2007/10/03)

HIV attachment via the CD4 receptor is an important target for developing novel approaches to HIV chemotherapy. Cyclotriazadisulfonamide (CADA) inhibits HIV at submicromolar levels by specifically down-modulating cell-surface and intracellular CD4. An effective five-step synthesis of CADA in 30% overall yield is reported. This synthesis has also been modified to produce more than 50 analogues. Many tail-group analogues have been made by removing the benzyl tail of CADA and replacing it with various alkyl, acyl, alkoxycarbonyl and aminocarbonyl substituents. A series of sidearm analogues, including two unsymmetrical compounds, have also been prepared by modifying the CADA synthesis, replacing the toluenesulfonyl sidearms with other sulfonyl groups. Testing 30 of these compounds in MT-4 cells shows a wide range of CD4 down-modulation potency, which correlates with ability to inhibit HIV-1. Three-dimensional quantitative structure-activity relationship (3D-QSAR) models were constructed using comparative molecular field analysis (CoMFA) and comparative molecular similarity indices analysis (CoMSIA) approaches. The X-ray crystal structures of four compounds, including CADA, show the same major conformation of the central 12-membered ring. The solid-state structure of CADA was energy minimized and used to generate the remaining 29 structures, which were similarly minimized and aligned to produce the 3D-QSAR models. Both models indicate that steric bulk of the tail group, and, to a lesser extent, the sidearms mainly determine CD4 down-modulation potency in this series of compounds.

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