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CAS No.: | 2343-89-7 |
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Name: | METHYL 2-FLUOROACRYLATE |
Article Data: | 34 |
Molecular Structure: | |
Formula: | C4H5FO2 |
Molecular Weight: | 104.081 |
Synonyms: | Acrylicacid, 2-fluoro-, methyl ester (6CI,7CI,8CI);Methyl a-fluoroacrylate;a-Fluoroacrylic acid methyl ester; |
Density: | 1.057 g/cm3 |
Boiling Point: | 75.9 °C at 760 mmHg |
Flash Point: | 1.1 °C |
Solubility: | Slightly soluble in water. |
Hazard Symbols: | Xi |
Risk Codes: | 10-36/37/38 |
Safety: | 16-26-36 |
Transport Information: | UN 1993 |
PSA: | 26.30000 |
LogP: | 0.64260 |
Methyl 2-Fluoro-3-(4-toluenesulfonyloxy)propanoate
methyl 2-fluoroprop-2-enoate
Conditions | Yield |
---|---|
With potassium phtalimide at -78 - 150℃; under 0.01 Torr; | 97% |
Methyl 3-chloro-2-fluoropropanoate
methyl 2-fluoroprop-2-enoate
Conditions | Yield |
---|---|
With 2,6-di-tert-butyl-4-methyl-phenol; sodium phosphate In 1-methyl-pyrrolidin-2-one at 150℃; under 112.511 - 225.023 Torr; | 95% |
With dimethyl amine In diethyl ether; benzene |
Conditions | Yield |
---|---|
With thionyl chloride at 5 - 35℃; for 2h; Concentration; Reagent/catalyst; | 93% |
methyl 2-fluoroprop-2-enoate
Conditions | Yield |
---|---|
With 2,6-di-tert-butyl-4-methyl-phenol; sodium carbonate In 1-methyl-pyrrolidin-2-one at 150℃; under 225.023 Torr; for 4h; | 92% |
methanol
1-chloro-1-fluoroethane
carbon monoxide
methyl 2-fluoroprop-2-enoate
Conditions | Yield |
---|---|
With dichloro[ferrocene-1,1'-diylbis(diisopropylphosphine-P)]palladium(II); triethylamine at 100℃; under 5250.53 Torr; for 8h; Reagent/catalyst; Autoclave; | 91.8% |
With bis(tri-t-butylphosphine)palladium(0) at 100℃; for 18h; Reagent/catalyst; Time; Autoclave; | 77.4% |
methanol
1-bromo-1-fluoroethylene
carbon monoxide
methyl 2-fluoroprop-2-enoate
Conditions | Yield |
---|---|
With bis-triphenylphosphine-palladium(II) chloride; lithium carbonate; triethylamine at 90℃; for 6h; Reagent/catalyst; Temperature; Autoclave; | 90.7% |
With dichloro[4,5-bis(diphenylphosphino)-9,9’-dimethylxanthene]palladium(II); triethylamine at 100℃; under 7500.75 Torr; for 8h; Reagent/catalyst; Autoclave; | 90.1% |
With bis-triphenylphosphine-palladium(II) chloride; tributyl-amine; lithium carbonate at 90℃; under 7500.75 Torr; for 6h; Reagent/catalyst; Autoclave; | 71.8 g |
methyl 2-fluoroprop-2-enoate
Conditions | Yield |
---|---|
With 2,6-di-tert-butyl-4-methyl-phenol; methoxybenzene at 120 - 130℃; under 500 Torr; Reagent/catalyst; Temperature; | 89.5% |
With 2,6-di-tert-butyl-4-methyl-phenol at 145℃; under 360 Torr; | 12.3 g |
Conditions | Yield |
---|---|
With 10H-phenothiazine; sulfuric acid; zinc In water at 82 - 86℃; for 0.333333h; | 85% |
With hydrogen sulfide; sodium N-nitroso-N-phenylhydroxylaminate; zinc In water at 100℃; | 82% |
With zinc | 80% |
With sulfuric acid; zinc |
methyl 2-fluoroprop-2-enoate
Conditions | Yield |
---|---|
With 10H-phenothiazine In sulfolane at 180℃; for 6h; | 83.9% |
methyl 2-fluoroprop-2-enoate
Conditions | Yield |
---|---|
With 4-methoxy-phenol at 170℃; for 9h; | 81.2% |
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The cas register number of Methyl 2-fluoroacrylate is 2343-89-7. In addition, the molecular formula is C4H5FO2 and the molecular weight is 104.08. The systematic name about this chemical is methyl 2-fluoroprop-2-enoate. Besides, it is a irritating chemical and should be stored in a cool and dry place.
Physical properties about Methyl 2-fluoroacrylate are: (1)ACD/LogP: 0.68; (2)ACD/LogD (pH 5.5): 0.68; (3)ACD/LogD (pH 7.4): 0.68; (4)ACD/BCF (pH 5.5): 1.95; (5)ACD/BCF (pH 7.4): 1.95; (6)ACD/KOC (pH 5.5): 56.12; (7)ACD/KOC (pH 7.4): 56.12; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 26.3 Å2; (11)Index of Refraction: 1.366; (12)Molar Refractivity: 22.08 cm3; (13)Molar Volume: 98.3 cm3; (14)Polarizability: 8.75 ×10-24cm3; (15)Surface Tension: 21 dyne/cm; (16)Density: 1.057 g/cm3; (17)Flash Point: 1.1 °C; (18)Enthalpy of Vaporization: 31.7 kJ/mol; (19)Boiling Point: 75.9 °C at 760 mmHg; (20)Vapour Pressure: 103 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical is flammable and it is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing. And you should keep away from sources of ignition. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: F/C(=C)C(=O)OC
(2)Std. InChI: InChI=1S/C4H5FO2/c1-3(5)4(6)7-2/h1H2,2H3
(3)Std. InChIKey: ZTZJVAOTIOAZGZ-UHFFFAOYSA-N