ChemicalBook--->CAS DataBase List--->913836-24-5

913836-24-5

913836-24-5 Structure

913836-24-5 Structure
IdentificationBack Directory
[Name]

1-BOC-4-NITROINDOLE
[CAS]

913836-24-5
[Synonyms]

1-BOC-4-NITROINDOLE
N-BOC-4-NITROINDOLE
4-Nitroindole, N-BOC protected
4-Nitroindole,N-BOCprotected97%
4-Nitroindole, N-BOC protected 97%
TERT-BUTYL 4-NITRO-1H-INDOLE-1-CARBOXYLATE
4-nitro-1-indolecarboxylic acid tert-butyl ester
4-nitro-indole-1-carboxylic acid tert-butyl ester
1H-Indole-1-carboxylic acid, 4-nitro-, 1,1-dimethylethyl ester
[Molecular Formula]

C13H14N2O4
[MDL Number]

MFCD08689543
[MOL File]

913836-24-5.mol
[Molecular Weight]

262.26
Chemical PropertiesBack Directory
[Melting point ]

91-94
[Boiling point ]

395.3±34.0 °C(Predicted)
[density ]

1.26±0.1 g/cm3(Predicted)
[storage temp. ]

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

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

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H317
[Precautionary statements ]

P280
[Hazard Codes ]

Xi
[Hazard Note ]

Irritant
[HS Code ]

2933998090
Spectrum DetailBack Directory
[Spectrum Detail]

1-BOC-4-NITROINDOLE(913836-24-5)1HNMR
Hazard InformationBack Directory
[Synthesis]

4-Nitroindole

4769-97-5

Di-tert-butyl dicarbonate

24424-99-5

1-BOC-4-NITROINDOLE

913836-24-5

A catalytic amount of 4-dimethylaminopyridine (DMAP) and di-tert-butyl dicarbonate (Boc2O, 5.9 g, 27.1 mmol) were sequentially added to a stirred solution of 4-nitroindole (4.0 g, 24.6 mmol) in dichloromethane (50 mL) at 0 °C. The reaction mixture was continued to be stirred at room temperature for 3 hours. After completion of the reaction, the reaction mixture was diluted with dichloromethane and washed with deionized water. The organic phase was separated and dried over anhydrous magnesium sulfate. The solvent was removed by concentration under reduced pressure to give 1-Boc-4-nitroindole as a white solid (6.14 g, 95% yield). Mass spectrum (ESI) m/z 262.1.

[References]

[1] Patent: US2009/227575, 2009, A1. Location in patent: Page/Page column 20
[2] Patent: US2010/36123, 2010, A1. Location in patent: Page/Page column 4; 5; 7; 8
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