2,4-difluorobenzyl alcohol
2,4-difluorobenzaldehyde
Conditions | Yield |
---|---|
With 2,2,6,6-Tetramethyl-1-piperidinyloxy free radical; copper diacetate In water; acetonitrile at 20℃; for 6h; Green chemistry; | 89% |
With nitric acid; ytterbium(III) triflate In 1,2-dichloro-ethane for 2h; Oxidation; Heating; | 80% |
Conditions | Yield |
---|---|
With rhodium(III) chloride trihydrate; hydrogen; triethylamine; triphenylphosphine In N,N-dimethyl acetamide at 90℃; under 7500.75 Torr; for 12h; Autoclave; | 76% |
2,4-difluorobromobenzene
formic acid ethyl ester
A
2,4-difluorobenzaldehyde
B
bis-(2,4-difluorophenyl)methanol
Conditions | Yield |
---|---|
With n-butyllithium In diethyl ether; hexane 1.) -78 deg C, 30 min, 2.) -78 to 20 deg C, overnight; | A 12.8% B 74% |
2,4-dichlorobenzaldeyhde
A
2,4-difluorobenzaldehyde
B
2-chloro-4-fluorobenzaldehyde
C
4-chloro-2-fluorobenzaldehyde
Conditions | Yield |
---|---|
With potassium fluoride In sulfolane at 220℃; for 12h; Product distribution; also with other 1) molar ratios, 2) solvents, 3) temperatures, 4) times; | A 66% B 7% C 5% |
With potassium fluoride In sulfolane at 220℃; for 12h; | A 66% B 7% C 5% |
With potassium fluoride In sulfolane at 220℃; for 12h; Yield given. Title compound not separated from byproducts; | A 13% B n/a C n/a |
1-(azidomethyl)-2,4-difluorobenzene
2,4-difluorobenzaldehyde
Conditions | Yield |
---|---|
With sodium dithionite; spermwhale myoglobin (H64V,V68A) In methanol; aq. phosphate buffer at 20℃; for 24h; pH=7; Catalytic behavior; | 60% |
With sodium dithionite In methanol; aq. phosphate buffer at 20℃; for 24h; pH=7; Catalytic behavior; Enzymatic reaction; |
Conditions | Yield |
---|---|
With potassium fluoride; 18-crown-6 ether; tetraphenylphosphonium bromide at 230℃; for 7h; | 49% |
N-(2,4-difluorobenzyl) N-(2-cyanoethyl)-4-methylaniline
A
2,4-difluorobenzaldehyde
B
3-(2-Dimethylaminomethyl-4-methyl-phenylamino)-propionitrile
C
N-(2-cyanoethyl) N-(2,4-difluorobenzyl)-2-amino-5-methylbenzaldehyde
Conditions | Yield |
---|---|
With water; trichlorophosphate In N,N-dimethyl-formamide Vilsmeier reaction; | A 30% B 39% C 42.5% |
With trichlorophosphate In N,N-dimethyl-formamide Vilsmeier reaction; | A 30% B 39% C 42.5% |
Dichloromethyl methyl ether
1,3-Difluorobenzene
A
bis(2,4-difluorophenyl)chloromethane
B
2,4-difluorobenzaldehyde
Conditions | Yield |
---|---|
With aluminum (III) chloride In dichloromethane | A n/a B 33% C n/a |
Conditions | Yield |
---|---|
With sodium molybdate; dihydrogen peroxide; sodium bromide In acetic acid at 105℃; for 0.111111h; Temperature; | 31.1% |
With chlorine anschliessenden Erwaermen mit H2SO4; | |
With bromine anschliessenden Erwaermen mit H2SO4; |
2,4-difluorobenzaldehyde
Conditions | Yield |
---|---|
With acetic acid |
N-(2,4-difluorobenzylidene)-4-methylaniline
2,4-difluorobenzaldehyde
Conditions | Yield |
---|---|
Multi-step reaction with 3 steps 1: 91 percent / sodium borohydride / Heating 2: 46 percent / CuCl 3: 30 percent / POCl3 / dimethylformamide / Vilsmeier reaction View Scheme |
N-(2,4-difluorobenzyl)-4-methylaniline
2,4-difluorobenzaldehyde
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1: 46 percent / CuCl 2: 30 percent / POCl3 / dimethylformamide / Vilsmeier reaction View Scheme |
Conditions | Yield |
---|---|
With n-butyllithium; ammonium chloride In N-methyl-acetamide; diethyl ether; hexane; water |
Conditions | Yield |
---|---|
Stage #1: 1,3-Difluorobenzene With potassium tert-butylate In tetrahydrofuran; chloroform at 30 - 40℃; for 2.5h; Stage #2: formic acid at 65℃; for 3h; Reagent/catalyst; Solvent; Temperature; |
Conditions | Yield |
---|---|
With sodium hydroxide In methanol Ambient temperature; | 100% |
With sodium hydroxide In methanol at 28℃; Claisen Schmidt condensation; | 75.3% |
propylamine
2,4-difluorobenzaldehyde
(E)-N-(2,4-difluorobenzylidene)propan-1-amine
Conditions | Yield |
---|---|
With magnesium sulfate In dichloromethane; water at 24.84℃; for 4h; | 100% |
2,4-difluorobenzaldehyde
4-methoxycarbonyl aniline
4-{[1-(2,4-difluoro-phenyl)-meth-(E)-ylidene]-amino}-benzoic acid methyl ester
Conditions | Yield |
---|---|
With toluene-4-sulfonic acid In toluene for 12h; | 100% |
With toluene-4-sulfonic acid In toluene for 12h; Reflux; | 100% |
2,4-difluorobenzaldehyde
phosphonic acid diethyl ester
diethyl [(2,4-difluorophenyl)(hydroxy)methyl]phosphonate
Conditions | Yield |
---|---|
With triethylamine at 0 - 20℃; | 100% |
2,4-difluorobenzaldehyde
2,4-difluorobenzyl alcohol
Conditions | Yield |
---|---|
With sodium tetrahydroborate In methanol at 0℃; Inert atmosphere; | 100% |
Stage #1: 2,4-difluorobenzaldehyde With C36H44F4N2Ni2P2; diphenylsilane In tetrahydrofuran at 45℃; for 3h; Schlenk technique; Inert atmosphere; Stage #2: With sodium hydroxide In tetrahydrofuran; methanol at 60℃; for 24h; Schlenk technique; Inert atmosphere; | 92% |
With methanol; sodium tetrahydroborate at 0℃; for 1h; | 88% |
Conditions | Yield |
---|---|
With Lewis acid | 100% |
With boron trifluoride diethyl etherate In dichloromethane at 0 - 25℃; | 78% |
2,4-difluorobenzaldehyde
Conditions | Yield |
---|---|
With hydrazine hydrate In ethanol at 20℃; for 1h; Inert atmosphere; | 100% |
With hydrazine hydrate In ethanol at 20℃; Inert atmosphere; |
2-amino-4-bromo-5-fluorophenol
2,4-difluorobenzaldehyde
4-bromo-2-[[(2,4-difluorophenyl)methylene]amino]-5-fluorophenol
Conditions | Yield |
---|---|
Stage #1: 2-amino-4-bromo-5-fluorophenol; 2,4-difluorobenzaldehyde With toluene-4-sulfonic acid In toluene for 0.5h; Heating / reflux; Stage #2: With triethylamine In toluene at 20℃; | 99% |
toluene-4-sulfonic acid In toluene for 0.5h; Heating / reflux; Dean-Stark apparatus; | 99% |
2,4-difluorobenzaldehyde
(benzothiazole-2-sulfonyl)-acetic acid ethyl ester
Conditions | Yield |
---|---|
With sodium azide; ammonium acetate In methanol; water at 30℃; for 4h; | 99% |
trimethyl phosphonoacetate
2,4-difluorobenzaldehyde
methyl (2E)-3-(2,4-difluorophenyl)prop-2-enoate
Conditions | Yield |
---|---|
Stage #1: trimethyl phosphonoacetate With potassium tert-butylate In tetrahydrofuran at 20℃; for 0.166667h; Stage #2: 2,4-difluorobenzaldehyde In tetrahydrofuran at 20℃; for 3.16667h; | 99% |
Stage #1: trimethyl phosphonoacetate With potassium tert-butylate In tetrahydrofuran at 20℃; for 0.166667h; Stage #2: 2,4-difluorobenzaldehyde In tetrahydrofuran at 20℃; for 3.16667h; | 99% |
With potassium tert-butylate In tetrahydrofuran at 20℃; for 5.5h; | 86% |
Conditions | Yield |
---|---|
With silica-supported tungstic acid In neat (no solvent) at 60℃; for 0.0833333h; Sonication; Green chemistry; | 99% |
2,4-difluorobenzaldehyde
4,4,5,5-tetramethyl-[1,3,2]-dioxaboralane
Conditions | Yield |
---|---|
With C34H28N6Zn In neat (no solvent) at 20℃; for 2h; Glovebox; Schlenk technique; | 99% |
6-hydroxybenzofuran-3-one
2,4-difluorobenzaldehyde
(Z)-2-(2,4-difluorobenzylidene)-6-hydroxybenzofuran-3(2H)-one
Conditions | Yield |
---|---|
With potassium hydroxide In water at 20℃; for 4h; | 98% |
2-Hydroxy-1,4-naphthoquinone
2,4-difluorobenzaldehyde
1,3-cylohexanedione
Conditions | Yield |
---|---|
With silica-supported tungstic acid In neat (no solvent) at 60℃; for 0.0666667h; Sonication; Green chemistry; | 98% |
Conditions | Yield |
---|---|
Stage #1: tertbutylhydrazine hydrochloride With sodium hydroxide In ethanol; water at 0℃; for 0.25h; Stage #2: 2,4-difluorobenzaldehyde With acetic acid In ethanol; water at 0 - 20℃; for 24h; diastereoselective reaction; | 98% |
2,4-difluorobenzaldehyde
Conditions | Yield |
---|---|
With sulfuric acid; potassium nitrate at 0 - 20℃; for 0.166667h; | 97.5% |
With sulfuric acid; potassium nitrate at 20℃; for 3h; | 95% |
2,4-difluorobenzaldehyde
aniline
N-<(2,4-difluorophenyl)methylene>benzamine
Conditions | Yield |
---|---|
In toluene for 2h; Heating; | 97% |
2-(3-fluoro-4-methoxyphenyl)-2-[(trimethylsilyl)oxy]acetonitrile
2,4-difluorobenzaldehyde
2,4-difluoro-α-[(trimethylsilyl)oxy]benzeneacetonitrile
Conditions | Yield |
---|---|
97% |
2,4-difluorobenzaldehyde
(2,4-difluorophenyl)hydrazinium chloride
Conditions | Yield |
---|---|
In ethanol at 80℃; for 1h; | 97% |
Conditions | Yield |
---|---|
In ethanol for 3.25h; Heating; | 96% |
4'-N-(N'-p-methoxyphenylurenyl)acetophenone
2,4-difluorobenzaldehyde
Conditions | Yield |
---|---|
With sodium hydroxide In methanol at 20℃; Claisen-Schmidt condensation; | 95% |
2,4-difluorobenzaldehyde
4'-N-(N'-p-chlorophenylurenyl)acetophenone
Conditions | Yield |
---|---|
With sodium hydroxide In methanol at 20℃; Claisen-Schmidt condensation; | 95% |
4-phenylpiperidine
2,4-difluorobenzaldehyde
2-(4-phenylpiperidin-1-yl)-4-fluorobenzaldehyde
Conditions | Yield |
---|---|
With potassium carbonate In N,N-dimethyl-formamide at 150℃; for 20h; | 95% |
4-tert-Butylaniline
2,4-difluorobenzaldehyde
allyltributylstanane
4-tert-butylphenyl[1-(2, 4-difluorophenyl)but-3-enyl]amine
Conditions | Yield |
---|---|
With trifluoroacetic acid In acetonitrile at 25℃; for 0.75h; Inert atmosphere; | 95% |
2,4-difluorobenzaldehyde
1-[2-hydroxy-4,6-dimethoxy-3-(2-methyl-2H-pyrazol-3-yl)-phenyl]ethanone
(E)-3-(2,4-difluorophenyl)-1-(2-hydroxy-4,6-dimethoxy-3-(1-methyl-1H-pyrazol-5-yl)phenyl)prop-2-en-1-one
Conditions | Yield |
---|---|
With sodium hydroxide In ethanol; water at 20℃; for 24h; Claisen-Schmidt Condensation; | 95% |
Stage #1: 1-[2-hydroxy-4,6-dimethoxy-3-(2-methyl-2H-pyrazol-3-yl)-phenyl]ethanone With sodium hydroxide In ethanol; water for 0.0833333h; Claisen-Schmidt Condensation; Stage #2: 2,4-difluorobenzaldehyde In ethanol; water at 20℃; for 24h; Claisen-Schmidt Condensation; |
7-methoxy-3-benzofuranone
2,4-difluorobenzaldehyde
(Z)-2-(2,4-difluorobenzylidene)-7-methoxybenzofuran-3(2H)-one
Conditions | Yield |
---|---|
With aluminum oxide In methanol for 48h; Reflux; Inert atmosphere; | 95% |
1H-indene-1,3(2H)-dione
2-amino-1-tert-butyl-4-cyanopyrrole
2,4-difluorobenzaldehyde
Conditions | Yield |
---|---|
With indium(III) chloride In ethanol for 2.5h; Reflux; | 95% |
Conditions | Yield |
---|---|
at 25℃; Paterno-Buechi Cycloaddition; Irradiation; Flow reactor; | 95% |
Conditions | Yield |
---|---|
In ethanol at 80℃; for 1h; | 95% |
Conditions | Yield |
---|---|
In ethanol for 2h; Heating; | 95% |
The 2,4-Difluorobenzaldehyde, with the CAS registry number 1550-35-2, is also known as 4-Fluoro-2-fluorobenzaldehyde. It belongs to the product categories of Fluorin-contained benzaldehyde series; Aromatic Aldehydes & Derivatives (substituted); Benzaldehyde; Fluorobenzene; Fluorobenzaldehyde Series; Aldehydes; C7; Carbonyl Compounds. Its EINECS number is 216-287-2. This chemical's molecular formula is C7H4F2O and molecular weight is 142.10. What's more, its systematic name is 2,4-Difluorobenzaldehyde. This chemical should be sealed and stored in a cool and dry place. Moreover, it should be protected from oxides, air and alkali. It should be ensured that the workshop is well ventilated or equipped with exhaust devices. It is used as intermediates in medicine, pesticide and liquid crystal materials.
Physical properties of 2,4-Difluorobenzaldehyde are: (1)ACD/LogP: 1.198; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.20; (4)ACD/LogD (pH 7.4): 1.20; (5)ACD/BCF (pH 5.5): 4.79; (6)ACD/BCF (pH 7.4): 4.79; (7)ACD/KOC (pH 5.5): 106.82; (8)ACD/KOC (pH 7.4): 106.82; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 17.07 Å2; (13)Index of Refraction: 1.514; (14)Molar Refractivity: 32.993 cm3; (15)Molar Volume: 109.519 cm3; (16)Polarizability: 13.08×10-24cm3; (17)Surface Tension: 35.1 dyne/cm; (18)Density: 1.297 g/cm3; (19)Flash Point: 64.276 °C; (20)Enthalpy of Vaporization: 40.501 kJ/mol; (21)Boiling Point: 168.572 °C at 760 mmHg; (22)Vapour Pressure: 1.6 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical is flammable, so you should keep it away from sources of ignition - No smoking. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing, gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc1ccc(F)cc1F
(2)Std. InChI: InChI=1S/C7H4F2O/c8-6-2-1-5(4-10)7(9)3-6/h1-4H
(3)Std. InChIKey: WCGPCBACLBHDCI-UHFFFAOYSA-N
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