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2-(N-METHYL-N-PHENYL)AMINOMETHYLBENZENEBORONIC ACID is a versatile chemical compound utilized in organic synthesis and medicinal chemistry. It is recognized for its boronic acid functional group, which is instrumental in Suzuki-Miyaura coupling reactions for the formation of carbon-carbon bonds. 2-(N-METHYL-N-PHENYL)AMINOMETHYLBENZENEBORONIC ACID's incorporation of amino and phenyl groups further enhances its applicability as a building block for the creation of a wide array of chemical structures. Its capacity to form stable complexes with biological molecules positions it as a valuable asset in the development of pharmaceuticals and in probing biological processes.

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  • 172940-58-8 Structure
  • Basic information

    1. Product Name: 2-(N-METHYL-N-PHENYL)AMINOMETHYLBENZENEBORONIC ACID
    2. Synonyms: 2-(N-METHYL-N-PHENYL)AMINOMETHYLBENZENEBORONIC ACID
    3. CAS NO:172940-58-8
    4. Molecular Formula: C14H16BNO2
    5. Molecular Weight: 241.09334
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 172940-58-8.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: N/A
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: N/A
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: 2-(N-METHYL-N-PHENYL)AMINOMETHYLBENZENEBORONIC ACID(CAS DataBase Reference)
    10. NIST Chemistry Reference: 2-(N-METHYL-N-PHENYL)AMINOMETHYLBENZENEBORONIC ACID(172940-58-8)
    11. EPA Substance Registry System: 2-(N-METHYL-N-PHENYL)AMINOMETHYLBENZENEBORONIC ACID(172940-58-8)
  • Safety Data

    1. Hazard Codes: Xi
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 172940-58-8(Hazardous Substances Data)

172940-58-8 Usage

Uses

Used in Pharmaceutical Development:
2-(N-METHYL-N-PHENYL)AMINOMETHYLBENZENEBORONIC ACID is used as a key building block for the development of pharmaceuticals and biologically active molecules. Its presence in the synthesis process aids in the creation of diverse chemical structures that can target specific biological pathways or receptors, contributing to the advancement of new drug therapies.
Used in Organic Synthesis:
In the field of organic synthesis, 2-(N-METHYL-N-PHENYL)AMINOMETHYLBENZENEBORONIC ACID is used as a reagent for the formation of carbon-carbon bonds through Suzuki-Miyaura coupling reactions. This application is crucial for constructing complex organic molecules and expanding the scope of synthetic chemistry.
Used in Biological Research:
2-(N-METHYL-N-PHENYL)AMINOMETHYLBENZENEBORONIC ACID is used as a chemical probe in biological research to study biological processes. Its ability to form stable complexes with biological molecules allows researchers to investigate the interactions and mechanisms of various biological systems, potentially leading to a better understanding of disease pathways and the development of targeted therapies.
Used in Drug Design:
In the industry of drug design, 2-(N-METHYL-N-PHENYL)AMINOMETHYLBENZENEBORONIC ACID is utilized as a versatile component in the construction of drug candidates. Its unique functional groups and structural features enable the design of molecules with specific binding affinities and selectivities, which is essential for the creation of effective and safe medications.

Check Digit Verification of cas no

The CAS Registry Mumber 172940-58-8 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,7,2,9,4 and 0 respectively; the second part has 2 digits, 5 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 172940-58:
(8*1)+(7*7)+(6*2)+(5*9)+(4*4)+(3*0)+(2*5)+(1*8)=148
148 % 10 = 8
So 172940-58-8 is a valid CAS Registry Number.

172940-58-8SDS

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 [2-[(N-methylanilino)methyl]phenyl]boronic acid

1.2 Other means of identification

Product number -
Other names -

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:172940-58-8 SDS

172940-58-8Relevant articles and documents

Reactivity of 2-formylphenylboronic acid toward secondary aromatic amines in amination-reduction reactions

Adamczyk-Wo?niak, Agnieszka,Fratila, Raluca M.,Madura, Izabela D.,Pawe?ko, Alicja,Sporzyński, Andrzej,Tumanowicz, Marta,Velders, Aldrik H.,Y?a, Jacek

experimental part, p. 6639 - 6642 (2012/01/14)

The synthesis of 2-(arylaminomethyl)phenylboronic acid via an amination-reduction reaction has been investigated within a model system comprising 2-formylphenylboronic acid and N-ethylaniline. Adoption of the appropriate reaction conditions influences the reactivity of 2-formylphenylboronic acid, enabling efficient synthesis of so-far unobtainable 2-(arylaminomethyl)phenylboronic compounds. The first crystal structure of the aromatic amine derivative has been determined and described.

Novel Molecular Sensors for Saccharides Based on the Interaction of Boronic Acid and Amines: Saccharide Sensing in Neutral Water

Sandanayake, K. R. A. Samankumara,Shinkai, Seiji

, p. 1083 - 1084 (2007/10/02)

The first known synthetic molecular colour sensor for saccharides is designed utilizing the boronic acid-amine interaction and visible colour changes were observed upon interaction with saccharides in neutral aqueous solutions.

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