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5405-17-4

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5405-17-4 Usage

Description

N-benzyl-m-toluidine, with the molecular formula C15H17N, is a chemical compound that serves as an essential intermediate in the synthesis of a variety of organic compounds, including dyes, pharmaceuticals, and agrochemicals. Recognized for its potential adverse health effects, it is classified as a substance of very high concern (SVHC) under the European Union's REACH regulation, necessitating careful handling and storage to mitigate risks to human health and the environment.

Uses

Used in Chemical Synthesis Industry:
N-benzyl-m-toluidine is utilized as a key intermediate in the production of various organic compounds, primarily for the synthesis of dyes, pharmaceuticals, and agrochemicals. Its role in these syntheses is crucial for creating a range of end products that have diverse applications across different sectors.
Used in Dye Manufacturing:
N-benzyl-m-toluidine is used as a precursor in the manufacturing of dyes, contributing to the development of colorants for various industrial applications, including textiles, plastics, and printing inks.
Used in Pharmaceutical Development:
In the pharmaceutical industry, n-benzyl-m-toluidine is employed as a building block in the synthesis of medicinal compounds, potentially leading to the creation of new drugs with therapeutic benefits.
Used in Agrochemical Production:
n-benzyl-m-toluidine also finds application in the agrochemical sector, where it is used in the synthesis of various agrochemicals, such as pesticides and herbicides, to enhance crop protection and yield.
Given its toxic nature and potential to cause harm if ingested, inhaled, or upon skin and eye contact, it is imperative that n-benzyl-m-toluidine is handled and stored with strict adherence to safety protocols to ensure the well-being of individuals and preservation of the environment.

Check Digit Verification of cas no

The CAS Registry Mumber 5405-17-4 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 5,4,0 and 5 respectively; the second part has 2 digits, 1 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 5405-17:
(6*5)+(5*4)+(4*0)+(3*5)+(2*1)+(1*7)=74
74 % 10 = 4
So 5405-17-4 is a valid CAS Registry Number.
InChI:InChI=1/C27H29N3O4/c1-27(2)13-20-25(21(31)14-27)24(16-6-11-22(33-4)23(12-16)34-5)19(15-28)26(29)30(20)17-7-9-18(32-3)10-8-17/h6-12,24H,13-14,29H2,1-5H3

5405-17-4SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name N-benzyl-3-methylaniline,hydrochloride

1.2 Other means of identification

Product number -
Other names m-Tolylbenzylamine

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:5405-17-4 SDS

5405-17-4Relevant articles and documents

In Situ Formation of Cationic π-Allylpalladium Precatalysts in Alcoholic Solvents: Application to C-N Bond Formation

Bailly, Aurélien,Bihel, Frédéric,Grimaud, Laurence,Oliva, Estefania,Schmitt, Martine,Steinsoultz, Philippe,Wagner, Patrick

, p. 560 - 567 (2022/01/03)

We report an efficient Buchwald-Hartwig cross-coupling reaction in alcoholic solvent, in which a low catalyst loading showed excellent performance for coupling aryl halides (I, Br, and Cl) with a broad set of amines, amides, ureas, and carbamates under mild conditions. Mechanistically speaking, in a protic and polar medium, extremely bulky biarylphosphine ligands interact with the dimeric precatalyst [Pd(π-(R)-allyl)Cl]2 to form the corresponding cationic complexes [Pd(π-(R)-allyl)(L)]Cl in situ and spontaneously. The resulting precatalyst further evolves under basic conditions into the corresponding L-Pd(0) catalyst, which is commonly employed for cross-coupling reactions. This mechanistic study highlights the prominent role of alcoholic solvents for the formation of the active catalyst.

Effect of the ancillary ligand in N-heterocyclic carbene iridium(III) catalyzed N-alkylation of amines with alcohols

Feng, Xinshu,Huang, Ming

, (2021/06/21)

A series of air-stable N-heterocyclic carbene (NHC) Ir(III) complexes (Ir1-6), bearing various combinations of chlorine, pyridine and NHC ligands, were assayed for the N-alkylation of amines with alcohols. It was found that Ir3, with two monodentate 1,3-bis-methyl-imidazolylidene (IMe) ligands, emerged as the most active complex. A large variety of amines and primary alcohols were efficiently converted into mono-N-alkylated amines in 53–96% yields. As a special highlight, for the challenging MeOH, selective N-monomethylation could be achieved using KOH as a base under an air atmosphere. Moreover, this catalytic system was successfully applied to the gram-scale synthesis of some valuable compounds.

Nickel?Copper bimetallic mesoporous nanoparticles: As an efficient heterogeneous catalyst for N-alkylation of amines with alcohols

Nasresfahani, Zahra,Kassaee, Mohamad Z.

, (2020/10/30)

A bimetallic catalyst (Ni/Cu-MCM-41) is prepared via co-condensation method. The latter is characterized by Fourier transform infrared (FT-IR), X-ray powder diffraction (XRD), scanning electron microscopy (SEM), energy dispersive X-ray spectroscopy (EDX), diffuse reflectance spectroscopy (DRS), and nitrogen adsorption–desorption analysis. Catalytic performance of Ni/Cu-MCM-41 is probed in N-alkylation of amines with alcohols through a hydrogen autotransfer process. Noteworthy, this catalytic system appears very efficient for synthesis of a range of secondary and tertiary amines in good to excellent isolated yields. Moreover, the catalyst is successfully recovered and reused four times without notable decrease in its activity.

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