ChemicalBook--->CAS DataBase List--->205744-17-8

205744-17-8

205744-17-8 Structure

205744-17-8 Structure
IdentificationBack Directory
[Name]

3-Pyridinemethanamine,6-fluoro-(9CI)
[CAS]

205744-17-8
[Synonyms]

(6-Fluoropyridin-3-yl)
6-Fluoro-3-pyridineMethanaMine
2-fluoro-5-(aminomethyl)pyridine
3-(Aminomethyl)-6-fluoropyridine
3-Pyridinemethanamine, 6-fluoro-
5-(Aminomethyl)-2-fluoropyridine
3-Pyridinemethanamine,6-fluoro-(9CI)
[Molecular Formula]

C6H7FN2
[MDL Number]

MFCD11100747
[MOL File]

205744-17-8.mol
[Molecular Weight]

126.13
Chemical PropertiesBack Directory
[Boiling point ]

63-65 °C(Press: 0.56 Torr)
[density ]

1.180±0.06 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Inert atmosphere,2-8°C
[pka]

7.73±0.29(Predicted)
[Appearance]

Colorless to light yellow Liquid
[InChI]

InChI=1S/C6H7FN2/c7-6-2-1-5(3-8)4-9-6/h1-2,4H,3,8H2
[InChIKey]

KYRWSLUCAPNJPI-UHFFFAOYSA-N
[SMILES]

C1=NC(F)=CC=C1CN
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319
[Precautionary statements ]

P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
[HS Code ]

2933399990
Hazard InformationBack Directory
[Uses]

6-Fluoro-3-pyridinemethanamine is a useful compound for the study of herbicidal activity of 2-cyano-3-[[(6-fluoro-3-pyridinyl)methyl]amino]acrylates.
[Synthesis]

5-Cyano-2-fluoropyridine

3939-12-6

3-Pyridinemethanamine,6-fluoro-(9CI)

205744-17-8

General procedure for the synthesis of (6-fluoropyridin-3-yl)methanamine from 6-fluoro-3-cyanopyridine: 6-fluoro-3-cyanopyridine (300 mg, 2.46 mmol) was dissolved in 2 mol/L ammonia/methanol solution (30 mL), nickel Ruanne (0.5 g) was added at room temperature and the reaction was carried out for 12 h under hydrogen atmosphere. Upon completion of the reaction, the reaction mixture was filtered through diatomaceous earth and washed with methanol (5 mL x 2). The filtrate was concentrated to dryness and the residue was purified by silica gel column chromatography (eluent ratio of dichloromethane: methanol = 100:4) to give 262 mg of yellow oily solid in 85% yield.

[References]

[1] Patent: CN106916101, 2017, A. Location in patent: Paragraph 0149; 0150
[2] Journal of Medicinal Chemistry, 2017, vol. 60, # 19, p. 7965 - 7983
Spectrum DetailBack Directory
[Spectrum Detail]

3-Pyridinemethanamine,6-fluoro-(9CI)(205744-17-8)1HNMR
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