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ChemicalBook--->CAS DataBase List--->884494-84-2

884494-84-2

884494-84-2 Structure

884494-84-2 Structure
IdentificationBack Directory
[Name]

2-FLUORO-4-IODONICOTINIC ACID METHYL ESTER
[CAS]

884494-84-2
[Synonyms]

Methyl 2-Fluoro-4-iodonicotinate
2-FLUORO-4-IODONICOTINIC ACID METHYL ESTER
Methyl 2-Fluoro-4-iodopyridin-3-ylcarbanate
Methyl 2-fluoro-4-iodopyridine-3-carboxylate
2-Fluoro-4-iodo-3-pyridinecarboxylic acid methyl ester
3-PYRIDINECARBOXYLIC ACID, 2-FLUORO-4-IODO-,METHYL ESTER
Methyl 2-fluoro-4-iodopyridine-3-carboxylate, 2-Fluoro-4-iodo-3-(methoxycarbonyl)pyridine
[Molecular Formula]

C7H5FINO2
[MDL Number]

MFCD04972401
[MOL File]

884494-84-2.mol
[Molecular Weight]

281.02
Chemical PropertiesBack Directory
[Boiling point ]

287℃
[density ]

1.913
[Fp ]

127℃
[storage temp. ]

under inert gas (nitrogen or Argon) at 2–8 °C
[pka]

-3.86±0.18(Predicted)
[Appearance]

White to off-white Solid
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H302+H312+H332-H315-H319-H335
[Precautionary statements ]

P280
[HS Code ]

2933399990
Spectrum DetailBack Directory
[Spectrum Detail]

2-FLUORO-4-IODONICOTINIC ACID METHYL ESTER(884494-84-2)1HNMR
Hazard InformationBack Directory
[Synthesis]

2-FLUORO-4-IODONICOTINIC ACID

884494-51-3

(TRIMETHYLSILYL)DIAZOMETHANE

18107-18-1

2-FLUORO-4-IODONICOTINIC ACID METHYL ESTER

884494-84-2

GENERAL STEPS: 2-Fluoro-4-iodonicotinic acid (5.13 g) was dissolved in a solvent mixture of ether (25 mL) and methanol (25 mL) under nitrogen protection. To this solution was slowly added a 10% hexane solution of trimethylsilylated diazomethane (32.9 g). The reaction mixture was stirred at room temperature for 3 hours. Upon completion of the reaction, the reaction solution was concentrated and the resulting residue was purified by silica gel column chromatography (eluent: hexane-ethyl acetate gradient) to afford methyl 2-fluoro-4-iodonicotinate (5.3 g). The structure of the product was confirmed by 1H NMR (300 MHz, DMSO-d6): δ 3.94 (3H, s), 7.98 (1H, dd, J = 5.3, 1.1 Hz), 8.07 (1H, dd, J = 5.3, 0.8 Hz).

[References]

[1] Patent: EP2921480, 2015, A1. Location in patent: Paragraph 0391; 0392
[2] Patent: WO2016/95204, 2016, A1. Location in patent: Page/Page column 62; 63
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