ChemicalBook--->CAS DataBase List--->124433-70-1

124433-70-1

124433-70-1 Structure

124433-70-1 Structure
IdentificationBack Directory
[Name]

2-Pyridinesulfonamide,6-fluoro-(9CI)
[CAS]

124433-70-1
[Synonyms]

6-Fluoro-2-Pyridinesulfonamide
6-Fluoropyridine-2-sulfonamide
2-Pyridinesulfonamide,6-fluoro-
2-Pyridinesulfonamide,6-fluoro-(9CI)
[Molecular Formula]

C5H5FN2O2S
[MDL Number]

MFCD18816593
[MOL File]

124433-70-1.mol
[Molecular Weight]

176.17
Chemical PropertiesBack Directory
[Boiling point ]

374.8±52.0 °C(Predicted)
[density ]

1.521±0.06 g/cm3(Predicted)
[storage temp. ]

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

9.00±0.60(Predicted)
[Appearance]

White to off-white Solid
[InChI]

InChI=1S/C5H5FN2O2S/c6-4-2-1-3-5(8-4)11(7,9)10/h1-3H,(H2,7,9,10)
[InChIKey]

WYYFSNSPYJRQLU-UHFFFAOYSA-N
[SMILES]

C1(S(N)(=O)=O)=NC(F)=CC=C1
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
Spectrum DetailBack Directory
[Spectrum Detail]

2-Pyridinesulfonamide,6-fluoro-(9CI)(124433-70-1)1HNMR
Hazard InformationBack Directory
[Synthesis]

6-FLUOROPYRIDINE-2-SULFONYL CHLORIDE

128583-07-3

2-Pyridinesulfonamide,6-fluoro-(9CI)

124433-70-1

General procedure for the synthesis of 6-fluoro-2-pyridinesulfonamide from 6-fluoro-2-pyridinesulfonyl chloride: 6-fluoro-2-pyridinesulfonyl chloride (2.0875 g, 10.67 mmol) was dissolved in acetonitrile (50 mL) which was pre-cooled to 0 °C, and concentrated ammonia (70 mL, 539 mmol) was added slowly and dropwise. The reaction mixture was stirred at 0 °C for 30 min, then gradually warmed up to room temperature and continued stirring for 2 h. The reaction was completed by concentration reduction under reduced pressure. After the reaction was completed, some acetonitrile was removed by concentration under reduced pressure, and the residue was freeze-dried to obtain the target product, 6-fluoropyridine-2-sulfonamide, as a dark gray solid in 95% yield. The product was analyzed by LC/MS, ESI-MS m/z: 177.0 [M+H]+. 1H NMR (400 MHz, DMSO-d6) δ: 8.26 (q, J = 7.9 Hz, 1H), 7.88 (ddd, J = 7.5, 2.3, 0.6 Hz, 1H), 7.63 (s, 2H), 7.48 (ddd, J = 8.3, 2.4, 0.6 Hz). 2.4, 0.6 Hz, 1H).

[References]

[1] Patent: WO2018/42316, 2018, A1. Location in patent: Page/Page column 116; 117
[2] Patent: WO2011/94953, 2011, A1. Location in patent: Page/Page column 62-63
[3] Patent: WO2011/95576, 2011, A1. Location in patent: Page/Page column 62-63
[4] Patent: US2011/195979, 2011, A1. Location in patent: Page/Page column 34-35
[5] Patent: US2016/95858, 2016, A1. Location in patent: Paragraph 2135; 2136
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