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ChemicalBook--->CAS DataBase List--->105728-90-3

105728-90-3

105728-90-3 Structure

105728-90-3 Structure
IdentificationMore
[Name]

2-FLUORO-5-METHOXYBENZALDEHYDE
[CAS]

105728-90-3
[Synonyms]

2-FLUORO-5-METHOXYBENZALDEHYDE
6-FLUORO-M-ANISALDEHYDE
2-Fluoro-5-methoxybenzaldehyde 98%
2-Fluoro-5-methoxybenzaldehyde98%
[EINECS(EC#)]

600-676-2
[Molecular Formula]

C8H7FO2
[MDL Number]

MFCD00070795
[Molecular Weight]

154.14
[MOL File]

105728-90-3.mol
Chemical PropertiesBack Directory
[Appearance]

clear yellow liquid
[Melting point ]

48-50 °C
[Boiling point ]

229-230 °C (lit.)
[density ]

1.237 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.532(lit.)
[Fp ]

226 °F
[storage temp. ]

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

powder to lump to clear liquid
[color ]

White or Colorless to Yellow
[Water Solubility ]

Slightly soluble in water.
[Sensitive ]

Air Sensitive
[BRN ]

4379088
[InChI]

InChI=1S/C8H7FO2/c1-11-7-2-3-8(9)6(4-7)5-10/h2-5H,1H3
[InChIKey]

DKIQXHIAEMGZGO-UHFFFAOYSA-N
[SMILES]

C(=O)C1=CC(OC)=CC=C1F
[CAS DataBase Reference]

105728-90-3(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi,Xn
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R22:Harmful if swallowed.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S37/39:Wear suitable gloves and eye/face protection .
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[HS Code ]

29130000
Hazard InformationBack Directory
[Chemical Properties]

clear yellow liquid
[Uses]

2-Fluoro-5-methoxybenzaldehyde may be used in the synthesis of:
  • 5,10,15,20-tetrakis(2-fluoro-5-methoxyphenyl)porphyrin
  • aryl(2-fluoro-5-methoxyphenyl)methanones
  • 5′-methoxy-4-nitro-2,2′,5-trifluorobenzophenone
  • 2-(2-fluoro-5-methoxybenzylidene)-1-(5-bromo-2-morpholinopyrimidin-4-yl) hydrazine
[General Description]

2-Fluoro-5-methoxybenzaldehyde can be prepared starting from 2-amino-5-methoxytoluene.
[Synthesis]

4-Fluoroanisole

459-60-9

N,N-Dimethylformamide

68-12-2

2-FLUORO-5-METHOXYBENZALDEHYDE

105728-90-3

1. In a dry reaction flask, 20 g of 4-fluoroanisole was dissolved in 230 ml of anhydrous tetrahydrofuran. 2. The reaction system was cooled to -78 °C. 3. 130 ml of 2.5 M n-butyllithium tetrahydrofuran solution was added dropwise, the temperature was maintained at -78 °C, and the reaction was stirred for 2 h. 4. N,N-dimethylformamide was added to the reaction system, which was then allowed to warm naturally to room temperature. 5. Stirring continued overnight at room temperature. 6. The reaction was allowed to warm naturally to room temperature. 5. Stirring was continued at room temperature overnight. 6. After completion of the reaction, the reaction was quenched by the addition of 1 N hydrochloric acid. 7. The reaction mixture was extracted with ethyl acetate, and the organic phases were combined. 8. The organic phases were dried with anhydrous sodium sulfate, filtered, and then concentrated to afford 17 g of 2-fluoro-5-methoxybenzaldehyde. 9. The reaction was continued at room temperature for 2 hours. 10.

[References]

[1] Tetrahedron Letters, 1992, vol. 33, # 49, p. 7499 - 7502
[2] Patent: CN107778264, 2018, A. Location in patent: Paragraph 0025; 0026
[3] Patent: CN107698535, 2018, A. Location in patent: Paragraph 0024; 0025; 0026
[4] Patent: CN108129415, 2018, A. Location in patent: Paragraph 0024-0026
Spectrum DetailBack Directory
[Spectrum Detail]

2-FLUORO-5-METHOXYBENZALDEHYDE(105728-90-3)1HNMR
2-FLUORO-5-METHOXYBENZALDEHYDE(105728-90-3)IR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

2-Fluoro-5-methoxybenzaldehyde, 98%(105728-90-3)
[Alfa Aesar]

2-Fluoro-5-methoxybenzaldehyde, 97%(105728-90-3)
[Sigma Aldrich]

105728-90-3(sigmaaldrich)
[TCI AMERICA]

6-Fluoro-m-anisaldehyde,>95.0%(GC)(105728-90-3)
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