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1,4-Difluoro-2-(methylsulfonyl)benzene is a chemical compound characterized by its molecular formula C8H6F2O2S. It is a highly reactive white crystalline solid that is widely recognized for its strong sulfone functional group. 1,4-Difluoro-2-(methylsulfonyl)benzene serves as a crucial intermediate in the synthesis of pharmaceuticals and agrochemicals, and its unique structure and properties contribute to its utility in the development of new materials and as a reagent in organic synthesis.

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  • 236739-03-0 Structure
  • Basic information

    1. Product Name: 1,4-Difluoro-2-(methylsulfonyl)benzene
    2. Synonyms: 2,5-DIFLUOROBENZYLMETHYLSULFON;1,4-Difluoro-2-(methylsulfonyl)benzene;1,4-Difluoro-2-(meth;2,5-Difluorophenyl methyl sulphone
    3. CAS NO:236739-03-0
    4. Molecular Formula: C7H6F2O2S
    5. Molecular Weight: 192.18
    6. EINECS: 927-269-5
    7. Product Categories: N/A
    8. Mol File: 236739-03-0.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 307.8 °C at 760 mmHg
    3. Flash Point: 139.9 °C
    4. Appearance: White to light yellow solid
    5. Density: 1.376 g/cm3
    6. Vapor Pressure: 0.00129mmHg at 25°C
    7. Refractive Index: 1.49
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: 1,4-Difluoro-2-(methylsulfonyl)benzene(CAS DataBase Reference)
    11. NIST Chemistry Reference: 1,4-Difluoro-2-(methylsulfonyl)benzene(236739-03-0)
    12. EPA Substance Registry System: 1,4-Difluoro-2-(methylsulfonyl)benzene(236739-03-0)
  • 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: 236739-03-0(Hazardous Substances Data)

236739-03-0 Usage

Uses

Used in Pharmaceutical Industry:
1,4-Difluoro-2-(methylsulfonyl)benzene is used as a key intermediate in the synthesis of various pharmaceuticals for its ability to contribute to the development of complex organic molecules that can be used in medicinal chemistry.
Used in Agrochemical Industry:
Similarly, in the agrochemical industry, 1,4-Difluoro-2-(methylsulfonyl)benzene is utilized as an intermediate in the production of agrochemicals, where its strong sulfone group can be incorporated into molecules with pesticidal or herbicidal properties.
Used in Material Science:
1,4-Difluoro-2-(methylsulfonyl)benzene is also used in material science for the development of new materials, leveraging its unique structural and chemical properties to create innovative compounds with specific applications.
Used as a Reagent in Organic Synthesis:
In organic synthesis, 1,4-Difluoro-2-(methylsulfonyl)benzene is employed as a reagent, facilitating various chemical reactions that lead to the formation of desired organic compounds.
Safety Note:
Given its potential hazardous nature, 1,4-Difluoro-2-(methylsulfonyl)benzene should be handled with care to prevent any adverse health effects, ensuring proper safety measures are in place during its use in research and industrial applications.

Check Digit Verification of cas no

The CAS Registry Mumber 236739-03-0 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 2,3,6,7,3 and 9 respectively; the second part has 2 digits, 0 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 236739-03:
(8*2)+(7*3)+(6*6)+(5*7)+(4*3)+(3*9)+(2*0)+(1*3)=150
150 % 10 = 0
So 236739-03-0 is a valid CAS Registry Number.
InChI:InChI=1/C7H6F2O2S/c1-12(10,11)7-4-5(8)2-3-6(7)9/h2-4H,1H3

236739-03-0SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 16, 2017

Revision Date: Aug 16, 2017

1.Identification

1.1 GHS Product identifier

Product name 1,4-difluoro-2-methylsulfonylbenzene

1.2 Other means of identification

Product number -
Other names 2,5-Difluorobenzylmethylsulfon

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:236739-03-0 SDS

236739-03-0Downstream Products

236739-03-0Relevant articles and documents

Asymmetric hydrogenation process

-

Page/Page column 5-6, (2008/06/13)

The present invention provides an asymmetric hydrogenation process for the preparation of chiral cycloalkanoindole DP receptor antagonists in high enantiomeric excess.

Methanesulfonylation of deactivated aromatics with superelectrophilic CH3so2F·3SbF5 and (CH3so2)2O-2CF3so 3H/B(O3SCF3)3 systems

Olah,Orlinkov,Oxyzoglou,Prakash, G.K. Suria

, p. 1573 - 1578 (2007/10/03)

Methanesulfonylation of various deactivated arenes, including tri- and tetrafluorobenzenes, was achieved in good yield under mild conditions using superelectrophilic CH3SO2F/3SbF5 and (CH3SO2O)2O/2CF3SO 3H-B(O3SCF3)3 reagent systems. 1998 MAHK "Hayka/Interperiodica".

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