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871333-01-6

2-METHYL-5-(PYRROLIDIN-1-YLSULFONYL)PHENYLBORONIC ACID is a chemical compound characterized by the molecular formula C14H20BNO4S. It is recognized for its unique structure, which includes a boronic acid group and a pyrrolidine sulfonamide group, and is utilized as a reagent in organic synthesis. 2-METHYL-5-(PYRROLIDIN-1-YLSULFONYL)PHENYLBORONIC ACID is particularly adept at forming carbon-carbon bonds and is known for its reactivity with a range of electrophiles and nucleophiles. Its versatility and potential in the synthesis of complex organic molecules have made it a valuable intermediate in various chemical processes, including the production of pharmaceuticals, agrochemicals, and other fine chemicals. 2-METHYL-5-(PYRROLIDIN-1-YLSULFONYL)PHENYLBORONIC ACID's significance in medicinal chemistry is further underscored by its applications in drug discovery and development.

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  • 871333-01-6 Structure

  • Basic information

    1. Product Name: 2-METHYL-5-(PYRROLIDIN-1-YLSULFONYL)PHENYLBORONIC ACID
    2. Synonyms: 2-METHYL-5-(PYRROLIDIN-1-YLSULFONYL)PHENYLBORONIC ACID;2-METHYL-5-(PYRROLIDIN-1-YLSULPHONYL)BENZENEBORONIC ACID;2-Methyl-5-(pyrrolidin-1-ylsulphonyl)benzeneboronic acid 98%;(2-Boronotoluene-4-sulfonyl)pyrrolidine;2-Methyl-5-(-1-pyrrolidinylsulfonyl)benzeneboronic acid, 98%;1-[(3-Borono-4-methylbenzene)sulphonyl]pyrrolidine, 2-Borono-4-(pyrrolidin-1-ylsulphonyl)toluene;2-methyl-5-(pyrrolidin-1-ylsulfonyl)phenylboronic acid2-METHYL-5-(PYRROLIDIN-1-YLSULFONYL)PHENYLBORONIC ACID;2-Methyl-5-(pyrrolidin-1-ylsulphonyl)benzeneboronicacid98%
    3. CAS NO:871333-01-6
    4. Molecular Formula: C11H16BNO4S
    5. Molecular Weight: 269.13
    6. EINECS: N/A
    7. Product Categories: blocks;BoronicAcids;Sulfonamides
    8. Mol File: 871333-01-6.mol

  • Chemical Properties

    1. Melting Point: 126-128
    2. Boiling Point: 490.3°C at 760 mmHg
    3. Flash Point: 250.3°C
    4. Appearance: /
    5. Density: 1.37g/cm3
    6. Vapor Pressure: 1.98E-10mmHg at 25°C
    7. Refractive Index: 1.601
    8. Storage Temp.: Keep Cold
    9. Solubility: N/A
    10. CAS DataBase Reference: 2-METHYL-5-(PYRROLIDIN-1-YLSULFONYL)PHENYLBORONIC ACID(CAS DataBase Reference)
    11. NIST Chemistry Reference: 2-METHYL-5-(PYRROLIDIN-1-YLSULFONYL)PHENYLBORONIC ACID(871333-01-6)
    12. EPA Substance Registry System: 2-METHYL-5-(PYRROLIDIN-1-YLSULFONYL)PHENYLBORONIC ACID(871333-01-6)

  • 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: 871333-01-6(Hazardous Substances Data)

871333-01-6 Usage

Uses

Used in Organic Synthesis:
2-METHYL-5-(PYRROLIDIN-1-YLSULFONYL)PHENYLBORONIC ACID is used as a reagent for the formation of carbon-carbon bonds, which is crucial in the synthesis of complex organic molecules. Its ability to react with various electrophiles and nucleophiles makes it a versatile tool in this field.
Used in Pharmaceutical Production:
In the pharmaceutical industry, 2-METHYL-5-(PYRROLIDIN-1-YLSULFONYL)PHENYLBORONIC ACID is used as an intermediate in the synthesis of various drugs. Its unique structure allows for the creation of molecules with specific therapeutic properties.
Used in Agrochemical Development:
2-METHYL-5-(PYRROLIDIN-1-YLSULFONYL)PHENYLBORONIC ACID also finds application in the agrochemical sector, where it is used in the synthesis of compounds with pesticidal or herbicidal properties, contributing to the development of effective crop protection agents.
Used in Medicinal Chemistry Research:
2-METHYL-5-(PYRROLIDIN-1-YLSULFONYL)PHENYLBORONIC ACID is utilized in medicinal chemistry for drug discovery and development. Its unique structural features make it a promising candidate for the design and synthesis of new pharmaceutical agents with potential therapeutic applications.

Check Digit Verification of cas no

The CAS Registry Mumber 871333-01-6 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 8,7,1,3,3 and 3 respectively; the second part has 2 digits, 0 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 871333-01:
(8*8)+(7*7)+(6*1)+(5*3)+(4*3)+(3*3)+(2*0)+(1*1)=156
156 % 10 = 6
So 871333-01-6 is a valid CAS Registry Number.
InChI:InChI=1/C11H16BNO4S/c1-9-4-5-10(8-11(9)12(14)15)18(16,17)13-6-2-3-7-13/h4-5,8,14-15H,2-3,6-7H2,1H3

871333-01-6 Well-known Company Product Price

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  • Alfa Aesar

  • (H52881)  2-Methyl-5-(-1-pyrrolidinylsulfonyl)benzeneboronic acid, 98%   

  • 871333-01-6

  • 250mg

  • 1235.0CNY

  • Detail

  • Alfa Aesar

  • (H52881)  2-Methyl-5-(-1-pyrrolidinylsulfonyl)benzeneboronic acid, 98%   

  • 871333-01-6

  • 1g

  • 3952.0CNY

  • Detail

871333-01-6SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name (2-Methyl-5-(pyrrolidin-1-ylsulfonyl)phenyl)boronic acid

1.2 Other means of identification

Product number -
Other names (2-methyl-5-pyrrolidin-1-ylsulfonylphenyl)boronic acid

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:871333-01-6 SDS

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