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195609-18-8

195609-18-8 Structure

195609-18-8 Structure
IdentificationBack Directory
[Name]

2-FLUORO-5-NITROPHENYLACETIC ACID
[CAS]

195609-18-8
[Synonyms]

2-FLUORO-5-NITROPHENYLACETIC
2-fluoro-5-nitrophenyl acetate
2-FLUORO-5-NITROPHENYLACETIC ACID
2-(2-fluoro-5-nitrophenyl)aceticaci
2-(2-Fluoro-5-nitrophenyl)acetic acid
Benzeneacetic acid, 2-fluoro-5-nitro-
3-(Carboxymethyl)-4-fluoronitrobenzene
2-FLUORO-5-NITROPHENYLACETIC ACID ISO 9001:2015 REACH
[EINECS(EC#)]

242-641-0
[Molecular Formula]

C8H6FNO4
[MDL Number]

MFCD04091773
[MOL File]

195609-18-8.mol
[Molecular Weight]

199.14
Chemical PropertiesBack Directory
[Melting point ]

149-150
[Boiling point ]

375.5±27.0 °C(Predicted)
[density ]

1.498
[storage temp. ]

Store at room temperature
[form ]

powder
[pka]

3.76±0.10(Predicted)
[color ]

Off white to faint lemon
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-36/37/39
[HazardClass ]

IRRITANT
[HS Code ]

2916399090
Hazard InformationBack Directory
[Chemical Properties]

Light yellow crystalline
[Uses]

2-Fluoro-5-nitrophenylacetic acid can be used to prepare thickened heterocyclic compounds as protein kinase inhibitors.
[Synthesis]

2-Fluorophenylacetic acid

451-82-1

2-FLUORO-5-NITROPHENYLACETIC ACID

195609-18-8

General procedure for the synthesis of 2-fluoro-5-nitrophenylacetic acid from o-fluorophenylacetic acid: o-fluorobenzoic acid (30.0 g, 0.19 mol) was dissolved in a mixed solution of concentrated sulfuric acid (50 mL) and water (10 mL). A mixed solution of fuming nitric acid (10 mL) and water (10 mL) was added slowly and dropwise at 0 °C. The reaction mixture was kept stirred at 0 °C for 30 min. Upon completion of the reaction, the resulting precipitate was collected by filtration and washed with cold water. Finally, the product was dried under vacuum to afford 2-(2-fluoro-5-nitrophenyl)acetic acid as a white solid (35.2 g, 91% yield).

[References]

[1] Patent: WO2010/91310, 2010, A1. Location in patent: Page/Page column 99
[2] Journal of the Chemical Society - Perkin Transactions 1, 1997, # 15, p. 2229 - 2235
[3] Tetrahedron, 2000, vol. 56, # 50, p. 9809 - 9818
[4] Patent: US2006/30609, 2006, A1. Location in patent: Page/Page column 15
Spectrum DetailBack Directory
[Spectrum Detail]

2-FLUORO-5-NITROPHENYLACETIC ACID(195609-18-8)1HNMR
2-FLUORO-5-NITROPHENYLACETIC ACID(195609-18-8)FT-IR
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