IL95496A - Process for the preparation of fluoropyridines - Google Patents

Process for the preparation of fluoropyridines

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Publication number
IL95496A
IL95496A IL9549690A IL9549690A IL95496A IL 95496 A IL95496 A IL 95496A IL 9549690 A IL9549690 A IL 9549690A IL 9549690 A IL9549690 A IL 9549690A IL 95496 A IL95496 A IL 95496A
Authority
IL
Israel
Prior art keywords
process according
compound
fluoropyridine
dichloro
chloropyridine
Prior art date
Application number
IL9549690A
Other languages
Hebrew (he)
Other versions
IL95496A0 (en
Inventor
D Friese David
M Elledge Jerry
Original Assignee
Dowelanco
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Filing date
Publication date
Application filed by Dowelanco filed Critical Dowelanco
Publication of IL95496A0 publication Critical patent/IL95496A0/en
Publication of IL95496A publication Critical patent/IL95496A/en

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Classifications

    • CCHEMISTRY; METALLURGY
    • C07ORGANIC CHEMISTRY
    • C07DHETEROCYCLIC COMPOUNDS
    • C07D213/00Heterocyclic compounds containing six-membered rings, not condensed with other rings, with one nitrogen atom as the only ring hetero atom and three or more double bonds between ring members or between ring members and non-ring members
    • C07D213/02Heterocyclic compounds containing six-membered rings, not condensed with other rings, with one nitrogen atom as the only ring hetero atom and three or more double bonds between ring members or between ring members and non-ring members having three double bonds between ring members or between ring members and non-ring members
    • C07D213/04Heterocyclic compounds containing six-membered rings, not condensed with other rings, with one nitrogen atom as the only ring hetero atom and three or more double bonds between ring members or between ring members and non-ring members having three double bonds between ring members or between ring members and non-ring members having no bond between the ring nitrogen atom and a non-ring member or having only hydrogen or carbon atoms directly attached to the ring nitrogen atom
    • C07D213/60Heterocyclic compounds containing six-membered rings, not condensed with other rings, with one nitrogen atom as the only ring hetero atom and three or more double bonds between ring members or between ring members and non-ring members having three double bonds between ring members or between ring members and non-ring members having no bond between the ring nitrogen atom and a non-ring member or having only hydrogen or carbon atoms directly attached to the ring nitrogen atom with hetero atoms or with carbon atoms having three bonds to hetero atoms with at the most one bond to halogen, e.g. ester or nitrile radicals, directly attached to ring carbon atoms
    • C07D213/61Halogen atoms or nitro radicals

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  • Chemical & Material Sciences (AREA)
  • Organic Chemistry (AREA)
  • Pyridine Compounds (AREA)

Description

PROCESS FOR THE PREPARATION OF FLUOROPYRIDINES ABSTRACT Fluoropyridine compounds having a fluoro substituent in at least one of the 2-, 4-, and 6--positions are prepared by treatment of an appropriate 2-, 4-, or 6-chloropyridine compound with excess hydrogen fluoride in a dipolar, aprotic solvent at an elevated temperature and super-atmospheric pressure. Thus, 3,5-dichloro-2,4,6-trifluoropyridine is prepared by heating a mixture of pentachloropyridine, N-methyl-2--pyrrolidinone , and hydrogen fluoride at about 220°C and about 900 kiloPascals of pressure. 6,595-F - 1 - 95496/2 FLUORINATION WITH HYDROGEN FLUORIDE The present invention relates to a process for preparing fluoropyridines from chloropyridines by treatment with hydrogen fluoride.
Fluoropyridines, such as 3 , 5-dichloro-2 , 4 , 6--trifluoropyridine, are valuable intermediates useful in the preparation of herbicides, insecticides, fungicides, fixed dyes, and other end use products. Certain of these compounds are taught to be preparable from the corresponding chloropyridines by exchange with alkali metal fluorides, either in a melt or in certain dipolar, aprotic solvents. Israeli Patent No. 33214, for example, teaches such a process employing potassium fluoride, a dipolar solvent, and a small amount of water. Certain of them are also taught to be preparable from the corresponding chloropyridines by exchange with hydrogen fluoride, either in the vapor phase or neat. For example, Israeli Patent No. 33799 teaches a vapor phase process employing an aluminum or chromium catalyst and British Patent Application No. 1,272,475 teaches a liquid phase process using excess hydrogen fluoride as the solvent. None of these methods are entirely satisfactory, however. Methods employing an alkali metal fluoride produce an alkali metal chloride as a by-product which must be disposed of, sold, or recycled. Known methods employing hydrogen fluoride are slow, require metal halide or carbon catalysts, and produce only low yields of the desired fluoropyridines. -2- It has now been found that fluoropyridine compounds can be prepared in good yield and at a reasonable reaction rate by combining chloropyridine compounds and hydrogen fluoride in a dipolar, aprotic solvent at an elevated temperature and an elevated pressure .
The invention includes a process which comprises preparing a fluoropyridine compound of the general formula wherein X2, X3, X4, X5, and X6 each independently represent F, CI, CF3, CHF2, CN, H, or CH3 with the provisos that at least one of X2, X4, and X^ represents F and no more than two of X2, X3, 4, X5, and X6 represent H or CH3, characterized by heating a mixture of a chloropyridine compound of the same general formula wherein X2, x3, XH, x5, and χ6 each independently represent F, CI, CF3, CHF2, CN, H, or CH3 with the provisos that at least one of χ2, χ , and χ6 represents CI and no more than two of X2, X3, X4, X5, and X6 represent H or CH^, 6,595-F -2- -3- hydrogen fluoride, and a dipolar, aprotic solvent to a temperature of between 160°C and 300°C and a pressure of between 100 kiloPascals and 7,000 kiloPascals for a sufficient amount of time to exchange at least one chlorine substituent in a 2-, 4-, or 6-position with fluorine and, optionally, recovering the fluoropyridine compound .
Preferred chloropyridine starting materials include pentachloropyridine , 2 , 3 > 5 , 6-tetrachloro-pyridine, and 2 , 6-dichloro-4-( trifluoromethyl )pyridine . Preferred dipolar, aprotic solvents include N-methyl-2--pyrrolidinone .
The fluoropyridine products obtained, such as 3 » 5-dichloro- , 4 , 6-trifluoropyridine , 3>5-dichloro-2,6--difluoropyridine , and 2,6-difluoro-M-( tri luoromethyl)-pyridine, which are useful as chemical intermediates for the preparation of a variety of valuable compounds, are produced in the process in good yield and in a reasonable amount of time without the generation of an alkali metal chloride by-product. The process, additionally obviates the need for catalysts, such as metal halides and activated carbon, that are often employed in hydrogen fluoride exchange reactions.
The process of the present invention is applicable to the preparation of a range of fluoropyridine compounds of the general formula 6,595-F -3- -4- wherein X2, χ3, χ5, and Χ^ each independently represent F, CI, CF3, CHF2> CN, H, or CH3 with the provisos that at least one of X2, x^, and ^ represents F and no more than two of X2, X3, 4, X5, and X6 represent H or CH3. Such compounds can be characterized as pyridines possessing at least one fluoro substituent in a 2-, 4-, or 6-position and possessing at least three total electron withdrawing substituents selected from F, CI, CF3, CHF2, and CN. Examples of fluoropyridine products preparable by the process include 3 , 5-dichloro--2, , 6-t ifluoropy idine, 2,4-difluoro-3>5,6-trichloro-pyridine, 2,6-difluoro-3 , , -trichloropyridine , 3,5-di-chloro-2, 6-difluoropyridine, 2,6-difluoro-4-( trifluoro-methyl ) pyridine , 2 , 6-difluoro-5-cyanopyridine , 4-methyl--2, 3 ,5-trifluoropyridine, 2 , -difluoro-6-(difluoro-methy1 ) pyridine , 3 , 5-dichloro-2 , 6-difluoro-4-( trifluoro-methyDpyridine, and 3 , 5-dichloro-4 , 6-difluoro-2-cyano-pyridine. A preferred product of the process is 3,5-di-chloro-2, ,6-trifluoropyridine.
The starting material chloropyridine compounds to which the process is applicable have the general formula 6,595-F -4- -5- wherein X2, 3, ch independently represent F, CI, CF3, CHF2, CN, H, or CH3 with the provisos that at least one of 2, X^, and X^ represents CI and no more than two of X2, X3, X4, X5, and X6 represent H or CH3. Such compounds can be characterized as pyridines possessing at least one chloro substituent in a 2-, 4-, or 6-position and possessing at least three total electron withdrawing substituents selected from F, CI, C 3, CHF2> and CN. Examples of chloropyridine starting materials include pentachloropyridine , 2, 6-difluoro-3 > , 5-trichloropyridine , 2 , 3 > 5 , 6-tetra-chloropyridine , 2 , 3 » , 5-tetrachloropyridine , 2,3>4,6--tetrachloropyridine , 2,3, 5-trichloropyridine, 2, 6-dichloro-4-cyanopyridine , 2,3, 4-trichloro-6-methyl-pyridine , 2 , 4-dichloro-6-( difluoromethyl ) pyridine , 2 , 3 ,6-trichloro-5-( t ifluorome hyl ) pyridine , 2, 6-di-chloro-4-(trifluoromethyl)pyridine, and 2-cyano-4,6--dichloro-3 > 5-difluoropy idine .
The process of the present invention requires a dipolar, aprotic solvent. This class of solvents is well known in the art and includes solvents such as N,N-dimethylformamide, Ν,Ν-dimethylacetamide , N-methyl--2-pyrrolidinone , 1 , 3-dimethyl-2-imidazolidinone , sulfolane, dimethyl sulfoxide, and hexamethylphosphor-amide. N-methyl-2-pyrrolidinone is a preferred solvent. A sufficient amount of solvent is generally employed to 6,595-F -5- -6- dissolve the starting chloropyridine compound at higher temperatures. Generally, a ratio of solvent to chloropyridine compound of 1:1 to 20:1 is suitable.
The hydrogen fluoride is generally employed in excess. Typically, 2 to 50 moles of hydrogen fluoride are employed for every chloro substituent exchanged. Thus, for example, to prepare 3 , 5-dichloro-2 , , 6-tri-fluoropyridine from pentachloropyridine 6 to 150 moles of hydrogen fluoride are generally employed for every mole of pentachloropyridine. Three to 40 moles are generally preferred.
The process is conducted by heating a mixture of the starting chloropyridine, a dipolar, aprotic solvent, and hydrogen fluoride at a sufficiently high temperature, under a sufficiently high pressure, and for a sufficient amount of time to exchange at least one chloro substituent in the 2-, 4-, or 6-position to a fluoro substituent in substantial conversion.
Temperatures of 160°C to 300°C are usually suitable and temperatures of 200°C to 250°C are generally preferred. Pressures of 100 to 7,000 kiloPascals are usually suitable and pressures of 300 to 3,600 kiloPascals are generally preferred. Pressures above those naturally attained in the system are generally achieved by adding an inert gas, such as nitrogen or argon.
When a substantial amount of the desired fluoropyridine compound has formed it can be recovered by conventional means. Methods involving distillation are often preferred. Since each of the reactants and products is volatile, separations are readily made by distillation. It is also appropriate to dilute with 6,595-F -6- water and separate the fluoropyridine as an insoluble liquid or solid.
It is possible, and in some instances preferable, to conduct the process in such a manner that the hydrogen chloride formed as a by-product distills from the reaction mixture as it forms. A reactor equipped with a f actionating distillation column capable of operating under pressure is required to accomplish this. When this embodiment of the invention is employed, it is possible to use less of an excess of hydrogen fluoride than when the hydrogen chloride is left in the mixture. Thus, it is preferred to employ 5 to HQ moles of hydrogen fluoride for every chloro substituent exchanged if the hydrogen chloride is not removed but only 3 to 10 if it is.
It is further possible, and in some instances preferable, to conduct the process in such a manner that the product fluoropyridine as well as the by-product hydrogen chloride is removed from the reaction mixture as it forms. In this embodiment of the process a more volatile portion of the reaction mixture is continuously removed from the mixture by distillation. The distillate obtained is fractionally distilled to separate and recover the desired fluoropyridine product and separate the hydrogen chloride by-product from the hydrogen fluoride reactants, any chloropyridine reactant or intermediate, and any solvent present in the distillate. The reactants, intermediates, and solvents are continuously returned to the reactor for further processing. 6,595-F -7- -8- The process can be conducted in either a batch mode or a continuous mode.
The process can be carried out in any reactor that is compatible with the reactants and products and is capable of super-atmospheric pressure operation.
Materials of construction resistant to corrosion by hydrogen chloride and hydrogen fluoride, are generally employed. Reactors coated with a fluorinated polymer, such as polytetrafluoroethylene , are especially useful for the process. When a metal that is too susceptible to corrosion by hydrogen chloride or hydrogen fluoride is employed, reductive dechlorination is a significant side reaction.
The following example is presented to illustrate the process of the invention. It should not be construed as limiting.
Example 1 - Preparation of 3 , 5-Dichloro-2 , 4 , 6-trifluoro-pyridine and 2 , 6-Difluoro-3 , 4 , 5-trichloropyridine From Pentachloropyridine A 250 milliliter polytetrafluoroethylene lined reactor equipped with stirring and heating means was employed. Pentachloropyridine (15.5 grams, 0.0616 mole), hydrogen fluoride (98.2 grams, 4.91 moles) and N-methyl-2-pyrrolidinone (124 grams) were placed in the reactor and heated with stirring at about 220°C.
Nitrogen gas was introduced to increase the pressure to about 900 kiloPascals . The reactor contents were sampled at intervals and the samples were analyzed by gas-liquid chromatography. The results are given in the following table: 6,595-F -8- -9- 3 ,5-Dichloro- Monofluoro- Difluoro- 2,4,6- Run Pentachloro- tetrachloro- trichloro- trifluoro- Time, pyridine, pyridines , pyridines* , pyridine , Hours Percent Percent Percent Percent 0.0 99.6 0.0 0.0 0.0 0.5 43.8 42.1 2.6 0.8 4.5 3.9 48.5 38.6 5.4 7.5 2.0 35.8 47.3 9.0 13.5 0.7 20.5 58.7 15.5 26.0 0.0 7.3 42.2 36.4 30.5 0.0 6.1 46.2 42.8 *A mixture of isomers in which 2 , 6-difluoro-3 » 4 , 5-trichloro--pyridine is predominant. 20 25 30 36,595-F -9-

Claims (10)

-10-
1. A process which comprises preparing a fluoropyridine compound of the general formula X' wherein X2, X3, X4, X5, and X6 each independently represent F, CI, CF3, CHF2, CN, H, or CH3 with the provisos that at least one of 2, X4, and X^ represents F and no more than two of X2, X3, X4, X5, and X6 represent H or CH3 characterized by heating a mixture of a chloropyridine compound of the same general formula wherein X2, X3, X4, X5, and X6 each independently represent F, CI, CF3, CHF2, CN, H, or CH3 with the provisos that at least one of X2, X4, and X^ represents CI and no more than two of X2, X3, X4, X5, and X6 represent H or CI^, 6,595-F -10- -11- hydrogen fluoride, and a dipolar, aprotic solvent to a temperature of between 160°C and 300°C and a pressure of between 100 and 7,000 kiloPascals for a sufficient amount of time to exchange at least one chlorine substituent in a 2-, 4-, or 6-position with fluorine and, optionally, recovering the fluoropyridine compound.
2. A process according to Claim 1 wherein the chloropyridine compound is pentachloropyridine or 2,3,5 , 6-tetrachloropyridine.
3. A process according to Claim 1 wherein the fluoropyridine compound is 3 » 5-dichloro-2 , 4 , 6-trifluoropyridine, 2,6-difluoro-3 > 4 , 5-trichloropyridine, or 3 , 5-dichloro-2 , 6-difluoropyridine .
4. A process according to Claim 2 wherein the chloropyridine compound is pentachloropyridine and the fluoropyridine compound is 3 » 5-dichloro-2 , , 6-trifluoropyridine .
5. A process according to any one of Claims 1 to 4 wherein the temperature is 200°C to 250°C.
6. A process according to any one of Claims 1 to 4 wherein the pressure is 300 to 3>600 kiloPascals.
7. A process according to any one of Claims 1 to 4 wherein the solvent is N-methyl-2-pyrrolidinone .
8. A process according to any one of Claims 1 to 4 wherein the hydrogen chloride by-product is removed as it forms by distillation.
9. A process according to any one of Claims 1 to 4 wherein the fluoropyridine compound is recovered. 6,595-F -11- -12-
10. A process according to Claim 9 wherein the fluoropyridine compound is recovered continuously by distillation . 36,595-F -12-
IL9549690A 1989-08-28 1990-08-27 Process for the preparation of fluoropyridines IL95496A (en)

Applications Claiming Priority (1)

Application Number Priority Date Filing Date Title
US07/399,748 US4999432A (en) 1989-08-28 1989-08-28 Fluorination with hydrogen fluoride

Publications (2)

Publication Number Publication Date
IL95496A0 IL95496A0 (en) 1991-06-30
IL95496A true IL95496A (en) 1994-04-12

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Application Number Title Priority Date Filing Date
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US (1) US4999432A (en)
EP (1) EP0415498A3 (en)
JP (1) JPH03163062A (en)
AU (1) AU6138090A (en)
CA (1) CA2024032A1 (en)
HU (1) HUT54985A (en)
IL (1) IL95496A (en)
RU (1) RU1838300C (en)

Families Citing this family (4)

* Cited by examiner, † Cited by third party
Publication number Priority date Publication date Assignee Title
US5315043A (en) * 1992-02-05 1994-05-24 E. I. Du Pont De Nemours And Company Aromatic nucleophilic fluorination
CA2714065A1 (en) * 2008-02-05 2009-08-13 Arysta Lifescience North America, Llc Solid formulation of low melting active compound
TWI520943B (en) * 2011-01-25 2016-02-11 陶氏農業科學公司 Process for the preparation of 4-amino-3-chloro-5-fluoro-6-(substituted)picolinates
CN108017574B (en) * 2017-12-20 2019-03-08 江苏中旗科技股份有限公司 A kind of method for continuous production of fluroxypyr intermediate 3,5-dichloro-2,4,6-trifluoropyridine

Family Cites Families (11)

* Cited by examiner, † Cited by third party
Publication number Priority date Publication date Assignee Title
GB1234543A (en) * 1969-02-25 1971-06-03
GB1272475A (en) * 1969-05-30 1972-04-26 Ici Ltd Manufacture of fluoropyridines
US4480102A (en) * 1982-07-23 1984-10-30 The Dow Chemical Company 2,3-Difluoro-5-(trifluoromethyl)pyridine and methods of making and using the same
US4590279A (en) * 1982-11-26 1986-05-20 The Dow Chemical Company Preparation of (trifluoromethyl)pyridines under liquid phase conditions
US4650875A (en) * 1983-05-09 1987-03-17 The Dow Chemical Company Preparation of (trifluoromethyl)pyridines
US4547577A (en) * 1984-06-08 1985-10-15 The Dow Chemical Company Preparation of (trifluoromethyl)pyridines
US4831148A (en) * 1984-10-10 1989-05-16 Ciba-Geigy Corporation Process for the preparation of fluorinated pyridine derivatives
GB8504268D0 (en) * 1985-02-19 1985-03-20 Shell Int Research Preparation of fluorinated pyridines
US4680406A (en) * 1985-10-15 1987-07-14 The Dow Chemical Company Process for fluorinating halogenated organo-compounds
US4746744A (en) * 1986-10-22 1988-05-24 The Dow Chemical Company Method of preparation of 3,5-dichloro-2,4,6-trifluoropyridine
US4782161A (en) * 1987-10-21 1988-11-01 The Dow Chemical Company Preparation of fluoropyridines

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Publication number Publication date
IL95496A0 (en) 1991-06-30
EP0415498A3 (en) 1991-08-07
HU905329D0 (en) 1991-02-28
AU6138090A (en) 1991-02-28
JPH03163062A (en) 1991-07-15
RU1838300C (en) 1993-08-30
CA2024032A1 (en) 1991-03-01
US4999432A (en) 1991-03-12
EP0415498A2 (en) 1991-03-06
HUT54985A (en) 1991-04-29

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