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73792-08-2

73792-08-2 Structure

73792-08-2 Structure
IdentificationBack Directory
[Name]

METHYL 4-AMINO-2-FLUOROBENZOATE
[CAS]

73792-08-2
[Synonyms]

METHYL 4-AMINO-2-FLUOROBENZOATE
Methyl 2-fluoro-4-aminobenzoate
2-Fluoro-4-aminobenzoic acid methyl ester
Benzoic acid,4-aMino-2-fluoro-, Methyl ester
[Molecular Formula]

C8H8FNO2
[MDL Number]

MFCD09037917
[MOL File]

73792-08-2.mol
[Molecular Weight]

169.15
Chemical PropertiesBack Directory
[Melting point ]

Too Dark to Visualize
[Boiling point ]

302.3±27.0 °C(Predicted)
[density ]

1.264±0.06 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[solubility ]

DMSO (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

1.45±0.10(Predicted)
[color ]

Orange to Brown
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302
[Precautionary statements ]

P280-P305+P351+P338
[HS Code ]

2916399090
Hazard InformationBack Directory
[Uses]

Methyl 4-amino-2-fluorobenzoate is mainly used as an intermediate in organic synthesis, especially in the field of pharmaceutical manufacturing.
[Synthesis]

METHYL 2-FLUORO-4-NITROBENZENECARBOXYLATE

392-09-6

METHYL 4-AMINO-2-FLUOROBENZOATE

73792-08-2

Step 2: Methyl 2-fluoro-4-nitrobenzoate (1.05 g, 5.273 mmol) was dissolved in methanol (MeOH). Palladium/carbon (Pd/C, 105 mg) was added to the resulting solution. The reaction mixture was stirred for 2 hours at room temperature in a hydrogen (H2) atmosphere. Upon completion of the reaction, the mixture was filtered through a diatomaceous earth pad to remove the catalyst. The filtrate was concentrated under reduced pressure to give the crude product. The crude product was purified by column chromatography to give the final pure methyl 4-amino-2-fluorobenzoate (870 mg, 98% yield).

[References]

[1] Bioorganic and Medicinal Chemistry, 2009, vol. 17, # 19, p. 7042 - 7051
[2] Patent: WO2013/68467, 2013, A1. Location in patent: Page/Page column 57; 59; 60; 61
[3] Bioorganic and Medicinal Chemistry Letters, 2005, vol. 15, # 2, p. 337 - 343
[4] Patent: WO2004/14900, 2004, A1. Location in patent: Page 52
[5] Journal of Organic Chemistry, 1990, vol. 55, # 7, p. 2034 - 2044
Spectrum DetailBack Directory
[Spectrum Detail]

METHYL 4-AMINO-2-FLUOROBENZOATE(73792-08-2)1HNMR
METHYL 4-AMINO-2-FLUOROBENZOATE(73792-08-2)19FNMR
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