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2,4′-Difluorobenzophenone

2,4′-Difluorobenzophenone structure

2,4′-Difluorobenzophenone 

structure
  • CAS No:

    342-25-6

  • Formula:

    C13H8F2O

  • Chemical Name:

    2,4′-Difluorobenzophenone

  • Synonyms:

    Methanone,(2-fluorophenyl)(4-fluorophenyl)-;(2-Fluorophenyl)(4-fluorophenyl)methanone;2,4′-Difluorobenzophenone

  • Categories:

    Agrochemicals  >  Pesticide Intermediates

Description

clear light yellow liquid after melting

2,4′-Difluorobenzophenone Basic Attributes

218.203

218.20

206-441-7

5YFK8V5BTE

DTXSID40187788

2914700090

Characteristics

17.1

3.5

colorless transparency liquid

1.2±0.1 g/cm3

22.8-23.6 °C

176-178 °C @ Press: 16 Torr

126.8±17.9 °C

1.550

Store in a cool, dry place. Keep container closed when not in use.

Safety Information

3

R36/37/38

S26-S37/39-S24/25

Xi:Irritant;

Stable under normal temperatures and pressures.

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

H315

2,4′-Difluorobenzophenone Use and Manufacturing

General procedure: 2-Fluorobenzoyl chloride (6 mmol, 1.0 eq) in 2-methyltetrahydrofuran (15 mL) and Compound 2 (9 mmol, 1.5 eq) of 2-methyltetrahydrofuran solution (15 mL) passed through material channels A and B, respectively, via metering pumps P1, P2.Mixing into a mixing module M having a preset temperature of 25 ° C at a flow rate of 1 mL/min, After staying in the reaction module L for 1 h, The reaction solution flows out from the outlet D.The reaction liquid flowing out from the outlet D was collected in a 1 mol/L hydrochloric acid solution.Quenched by stirring, Saturated saline solution, Dry over anhydrous sodium sulfate, Post-treatment by concentration, column chromatography, etc.Compound 5 was obtained.Method of the present embodiment provides a 2, 4 ′-difluorobenzophenone and preparation method thereof, as follows: in a 1000 ml round bottom flask The bottle was added sequentially o-fluoro benzaldehyde 124 g of 4-fluorophenylboronic acid and 140 g of potassium phosphate, 106 grams, 1.12 g of palladium acetate, then adding 500 ml of methyl cyclohexane and 100 ml of water and heated to reflux for 8 hours., sequentially passes through filtering, layering, washing with water, removing the solvent to obtain the product., 2, 4 '-difluorobenzophenone 214 g, 98percent yield.General procedure: 2-Fluorobenzoyl chloride (6 mmol, 1.0 eq) in 2-methyltetrahydrofuran (15 mL) and Compound 2 (9 mmol, 1.5 eq) of 2-methyltetrahydrofuran solution (15 mL) passed through material channels A and B, respectively, via metering pumps P1, P2.Mixing into a mixing module M having a preset temperature of 25 ° C at a flow rate of 1 mL/min, After staying in the reaction module L for 1 h, The reaction solution flows out from the outlet D.The reaction liquid flowing out from the outlet D was collected in a 1 mol/L hydrochloric acid solution.Quenched by stirring, Saturated saline solution, Dry over anhydrous sodium sulfate, Post-treatment by concentration, column chromatography, etc.Compound 5 was obtained.Method of the present embodiment provides a 2, 4 ′-difluorobenzophenone and preparation method thereof, as follows: in a 1000 ml round bottom flask The bottle was added sequentially o-fluoro benzaldehyde 124 g of 4-fluorophenylboronic acid and 140 g of potassium phosphate, 106 grams, 1.12 g of palladium acetate, then adding 500 ml of methyl cyclohexane and 100 ml of water and heated to reflux for 8 hours., sequentially passes through filtering, layering, washing with water, removing the solvent to obtain the product., 2, 4 '-difluorobenzophenone 214 g, 98percent yield.

Computed Properties

Molecular Weight:218.20
XLogP3:3.5
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:218.05432120
Monoisotopic Mass:218.05432120
Topological Polar Surface Area:17.1
Heavy Atom Count:16
Complexity:246
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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