ChemicalBook--->CAS DataBase List--->84531-36-2

84531-36-2

84531-36-2 Structure

84531-36-2 Structure
IdentificationBack Directory
[Name]

3-NITRO-6,7-DIHYDRO-5H-CYCLOPENTA[B]PYRIDINE
[CAS]

84531-36-2
[Synonyms]

3-nitro-5H,6H,7H-cyclopenta[b]pyridine
6,7-dihydro-3-nitro-5H-Cyclopenta[b]pyridine
3-NITRO-6,7-DIHYDRO-5H-CYCLOPENTA[B]PYRIDINE
5H-Cyclopenta[b]pyridine,6,7-dihydro-3-nitro-
3-NITRO-6,7-DIHYDRO-5H-CYCLOPENTA[B]PYRIDINE ISO 9001:2015 REACH
[Molecular Formula]

C8H8N2O2
[MDL Number]

MFCD09800609
[MOL File]

84531-36-2.mol
[Molecular Weight]

164.16
Chemical PropertiesBack Directory
[Melting point ]

94-95 °C
[Boiling point ]

277.9±40.0 °C(Predicted)
[density ]

1.328±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[pka]

2.15±0.20(Predicted)
[Appearance]

Light yellow to yellow Solid
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

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

3-NITRO-6,7-DIHYDRO-5H-CYCLOPENTA[B]PYRIDINE(84531-36-2)1HNMR
Hazard InformationBack Directory
[Synthesis]

1-METHYL-3,5-DINITRO-1H-PYRIDIN-2-ONE

14150-94-8

Cyclopentanone

120-92-3

3-NITRO-6,7-DIHYDRO-5H-CYCLOPENTA[B]PYRIDINE

84531-36-2

GENERAL METHOD: 1-methyl-3,5-dinitro-1H-pyridin-2-one (50 mg, 0.25 mmol) was dissolved in ethanol (5 mL), followed by cyclopentanone (26 μL, 0.25 mmol) and ammonium acetate (289 mg, 3.75 mmol). The reaction mixture was heated in an oil bath at 65 °C for 24 hours. After completion of the reaction, the solvent was removed by rotary evaporation and the residue was washed with benzene (3 × 10 mL) to afford 3-nitro-6,7-dihydro-5-hydro-cyclopenta[b]pyridine (42 mg, 0.24 mmol, 95% yield) as a yellow powder. The reaction of other ketones with 1-methyl-3,5-dinitro-1H-pyridin-2-one was carried out according to similar conditions. When microwave heating was used, the reaction conditions were the same as described above.

[References]

[1] Synthesis (Germany), 2014, vol. 46, # 16, p. 2175 - 2178
[2] Bulletin of the Chemical Society of Japan, 1990, vol. 63, # 10, p. 2820 - 2827
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