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2,6-Difluoromandelic Acid is an organic compound that falls under the category of aromatic homomonocyclic compounds. It is characterized by its molecular structure which includes two fluorine atoms, eight hydrogen atoms, four carbon atoms, and three oxygen atoms, resulting in the molecular formula C8H6F2O3. This chiral, aromatic fluorinated compound is known for its crystalline solid form and exhibits an acidic nature due to the presence of a carboxyl group (-COOH) in its molecular structure. It is commonly utilized in the synthesis of various pharmaceuticals.

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  • 207981-50-8 Structure
  • Basic information

    1. Product Name: 2,6-DIFLUOROMANDELIC ACID
    2. Synonyms: 2-(2,6-difluorophenyl)-2-hydroxyacetic acid;2,6-Difluoromandelicacid90%;(2,6-Difluorophenyl)(hydroxy)acetic acid;2,6-DIFLUOROMANDELIC ACID;alpha-Hydroxy-2,6-difluorophenylacetic acid;2,6-Difluoromandelic acid, tech.;à-hydroxy-2,6-difluorophenylacetic acid;2,6-Difluoromandelicacid,tech.90%
    3. CAS NO:207981-50-8
    4. Molecular Formula: C8H6F2O3
    5. Molecular Weight: 188.13
    6. EINECS: -0
    7. Product Categories: Miscellaneous
    8. Mol File: 207981-50-8.mol
  • Chemical Properties

    1. Melting Point: 142-145°C
    2. Boiling Point: 299.258 °C at 760 mmHg
    3. Flash Point: 134.787 °C
    4. Appearance: /
    5. Density: 1.523 g/cm3
    6. Vapor Pressure: 0.000539mmHg at 25°C
    7. Refractive Index: 1.542
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. PKA: 3.24±0.10(Predicted)
    11. CAS DataBase Reference: 2,6-DIFLUOROMANDELIC ACID(CAS DataBase Reference)
    12. NIST Chemistry Reference: 2,6-DIFLUOROMANDELIC ACID(207981-50-8)
    13. EPA Substance Registry System: 2,6-DIFLUOROMANDELIC ACID(207981-50-8)
  • Safety Data

    1. Hazard Codes: Xi
    2. Statements: 36/37/38
    3. Safety Statements: 26-36
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: IRRITANT
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 207981-50-8(Hazardous Substances Data)

207981-50-8 Usage

Uses

Used in Pharmaceutical Industry:
2,6-Difluoromandelic Acid is used as a key intermediate in the synthesis of pharmaceuticals for its unique properties and reactivity. Its incorporation in drug development allows for the creation of novel compounds with potential therapeutic applications.
Used in Medicinal Chemistry Research:
In the field of medicinal chemistry, 2,6-Difluoromandelic Acid serves as a valuable building block for the design and synthesis of new drug candidates. Its fluorinated nature and chirality contribute to the exploration of structure-activity relationships and the optimization of drug efficacy and selectivity.
Used in Drug Synthesis:
2,6-Difluoromandelic Acid is employed as a reactant in the synthesis of various drugs, particularly those targeting specific biological pathways or receptors. Its presence in the molecular structure of these drugs can influence their pharmacokinetic and pharmacodynamic properties, potentially leading to improved therapeutic outcomes.

Check Digit Verification of cas no

The CAS Registry Mumber 207981-50-8 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 2,0,7,9,8 and 1 respectively; the second part has 2 digits, 5 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 207981-50:
(8*2)+(7*0)+(6*7)+(5*9)+(4*8)+(3*1)+(2*5)+(1*0)=148
148 % 10 = 8
So 207981-50-8 is a valid CAS Registry Number.
InChI:InChI=1/C8H6F2O3/c9-4-2-1-3-5(10)6(4)7(11)8(12)13/h1-3,7,11H,(H,12,13)

207981-50-8 Well-known Company Product Price

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  • Alfa Aesar

  • (L12773)  2,6-Difluoromandelic acid, 97%   

  • 207981-50-8

  • 250mg

  • 272.0CNY

  • Detail
  • Alfa Aesar

  • (L12773)  2,6-Difluoromandelic acid, 97%   

  • 207981-50-8

  • 1g

  • 757.0CNY

  • Detail

207981-50-8SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 13, 2017

Revision Date: Aug 13, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-(2,6-difluorophenyl)-2-hydroxyacetic acid

1.2 Other means of identification

Product number -
Other names 2,6-Difluoromandelic 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:207981-50-8 SDS

207981-50-8Relevant articles and documents

METHOD OF PRODUCING BENZENE COMPOUND

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, (2016/12/01)

PROBLEM TO BE SOLVED: To provide a new production method for the benzene compound represented by formula (2). SOLUTION: The present invention provides a production method for the benzene compound represented by formula (2), the method including mixing of a compound represented by formula (1) and dimethyl sulfoxide (where R1, R2, R3, R4 and R5 independently represent a hydrogen atom, a halogen atom, an alkyl group, a fluorinated alkyl group, a hydroxyl group, an alkoxy group, an aryl group or a nitro group). COPYRIGHT: (C)2016,JPOandINPIT

Anti-viral compounds

-

, (2008/06/13)

The present invention relates to compounds of Formula (I) below, which inhibit the growth of picornaviruses, Hepatitus viruses, enteroviruses, cardioviruses, polioviruses, coxsackieviruses of the A and B groups, echo virus and Mengo virus. wherein: A is phenyl, pyridyl, substituted phenyl, substituted pyridyl, or benzyl; R is hydrogen, COR4, or COCF3; X is N—OH, O, or CHR1; R1is hydrogen, halo, CN, C1-C4alkyl, —C≡CH, CO(C1-C4alkyl), CO2(C1-C4alkyl), or CONR2R3; R2and R3are independently hydrogen or C1-C4alkyl; A′ is hydrogen, halo, C1-C6alkyl, benzyl, naphthyl, thienyl, furyl, pyridyl, pyrollyl, COR4, S(O)nR4, or a group of the formula R4is C1-C6alkyl, phenyl, or substituted phenyl; n is 0, 1, or 2; R5is independently at each occurrence hydrogen or halo; m is 1, 2, 3, or 4; and R6is hydrogen, halo, CF3, OH, CO2H, NH2, NO2, CONHOCH3, C1-C4alkyl, or CO2(C1-C4alkyl), C1-C4alkoxy; or a pharmaceutically acceptable salt thereof.

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