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CAS

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124244-65-1

2-Bromo-3,6-difluorobenzoic acid is a chemical compound with the molecular formula C7H3BrF2O2. It is a white crystalline solid that is often used as a building block in the synthesis of pharmaceuticals and agrochemicals. As a derivative of benzoic acid, it contains two fluorine atoms and one bromine atom attached to the benzene ring, which endows it with strong acidity. 2-Bromo-3,6-difluorobenzoic acid has been studied for its potential applications in various fields, including medicinal chemistry and materials science.

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  • 124244-65-1 Structure

  • Basic information

    1. Product Name: 2-Bromo-3,6-difluorobenzoic acid
    2. Synonyms: 2-Bromo-3,6-difluorobenzoic acid
    3. CAS NO:124244-65-1
    4. Molecular Formula: C7H3BrF2O2
    5. Molecular Weight: 236.9983264
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 124244-65-1.mol

  • Chemical Properties

    1. Melting Point: 111-113 °C(Solv: heptane (142-82-5))
    2. Boiling Point: 281.8±40.0 °C(Predicted)
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1.872±0.06 g/cm3(Predicted)
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. PKA: 1.58±0.10(Predicted)
    10. CAS DataBase Reference: 2-Bromo-3,6-difluorobenzoic acid(CAS DataBase Reference)
    11. NIST Chemistry Reference: 2-Bromo-3,6-difluorobenzoic acid(124244-65-1)
    12. EPA Substance Registry System: 2-Bromo-3,6-difluorobenzoic acid(124244-65-1)

  • Safety Data

    1. Hazard Codes: N/A
    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: 124244-65-1(Hazardous Substances Data)

124244-65-1 Usage

Uses

Used in Pharmaceutical Industry:
2-Bromo-3,6-difluorobenzoic acid is used as a building block for the synthesis of various pharmaceuticals due to its unique chemical structure and strong acidity. Its presence in the molecular structure of drugs can enhance their pharmacological properties, such as potency, selectivity, and bioavailability.
Used in Agrochemical Industry:
2-Bromo-3,6-difluorobenzoic acid is used as a key intermediate in the synthesis of agrochemicals, including pesticides and herbicides. Its strong acidity and unique functional groups contribute to the development of effective and environmentally friendly agrochemicals.
Used in Organic Chemistry Research:
2-Bromo-3,6-difluorobenzoic acid is used as a reagent in various organic chemistry reactions, such as esterification, amidation, and acylation. Its strong acidity facilitates the formation of desired products and improves the efficiency of the reactions.
Used in Materials Science:
2-Bromo-3,6-difluorobenzoic acid has potential applications in materials science, such as the development of new polymers, coatings, and adhesives. Its unique chemical structure and properties can contribute to the creation of innovative materials with improved performance and functionality.

Check Digit Verification of cas no

The CAS Registry Mumber 124244-65-1 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,2,4,2,4 and 4 respectively; the second part has 2 digits, 6 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 124244-65:
(8*1)+(7*2)+(6*4)+(5*2)+(4*4)+(3*4)+(2*6)+(1*5)=101
101 % 10 = 1
So 124244-65-1 is a valid CAS Registry Number.
InChI:InChI=1S/C7H3BrF2O2/c8-6-4(10)2-1-3(9)5(6)7(11)12/h1-2H,(H,11,12)

124244-65-1SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 14, 2017

Revision Date: Aug 14, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-bromo-3,6-difluorobenzoic 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:124244-65-1 SDS

124244-65-1Downstream Products

124244-65-1Relevant articles and documents

Regioselective ortho-lithiation of chloro and bromo substituted fluoroarenes

Mongin, Florence,Schlosser, Manfred

, p. 6551 - 6554 (2007/10/03)

Deprotonation of fluoroarenes carrying chlorine or bromine as additional substituents occurs always at a fluorine adjacent position if accomplished with potassium tert-butoxide activated butyllithium or lithium 2,2,6,6-tetramethylpiperidide.

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