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CAS No.: | 1408282-26-7 |
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Name: | 8-fluoro-1,3,4,5-tetrahydro-azepino[5,4,3-cd]indol-6-one |
Article Data: | 11 |
Molecular Structure: | |
Formula: | C11H9FN2O |
Molecular Weight: | 204.204 |
Synonyms: | 8-fluoro-1,3,4,5-tetrahydro-azepino[5,4,3-cd]indol-6-one;8-fluoro-4,5-dihydro-1H-azepino[5,4,3-cd]indol-6(3H)-one;8-Fluoro-1,3,4,5-tetrahydro-6H-pyrrolo[4,3,2-ef][2]benzazepin-6-one;8-fluoro-3,4-dihydro-2H-azepino[5,4,3-cd]indol-1(6H)-one;8-fluoro-2,3,4,6-tetrahydro-1H-azepino[5,4,3-cd]indol-1-one |
EINECS: | -0 |
Density: | 1.404±0.06 g/cm3(Predicted) |
Boiling Point: | 526.5±50.0 °C(Predicted) |
PSA: | 48.38000 |
LogP: | 1.60330 |
6-fluoro-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4(13),5,7-tetraen-9-one
Conditions | Yield |
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With 5%-palladium/activated carbon; hydrogen; acetic acid In methanol at 40℃; under 4500.45 Torr; Pressure; Reagent/catalyst; Temperature; | 95.7% |
3-(2-(phthalimido)ethyl)-6-fluoro-1H-indole-4-carboxylic acid methyl ester
6-fluoro-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4(13),5,7-tetraen-9-one
Conditions | Yield |
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With methylamine In water at 0 - 20℃; for 24h; | 94% |
With methylamine In water at 20℃; for 17h; Large scale; | 89% |
6-fluoro-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4(13),5,7-tetraen-9-one
Conditions | Yield |
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With palladium on activated charcoal; hydrogen In methanol at 40℃; under 15001.5 Torr; for 8h; Solvent; Temperature; Industrial scale; | 81.4% |
6-fluoro-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4(13),5,7-tetraen-9-one
Conditions | Yield |
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With tributylsilane; trifluoroacetic acid In dichloromethane at 0 - 20℃; for 8h; Reagent/catalyst; | 78% |
6-fluoro-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4(13),5,7-tetraen-9-one
Conditions | Yield |
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With water; 1,8-diazabicyclo[5.4.0]undec-7-ene In tetrahydrofuran at 20℃; for 24h; | 75% |
4-chlorobutyraldehyde
6-fluoro-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4(13),5,7-tetraen-9-one
Conditions | Yield |
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In ethanol; water for 7h; Reflux; | 73.2% |
6-fluoro-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4(13),5,7-tetraen-9-one
Conditions | Yield |
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With tributylsilane; boron trifluoride diethyl etherate In dichloromethane at 0 - 20℃; for 12h; Reagent/catalyst; | 69% |
4-chlorobutyraldehyde
6-fluoro-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4(13),5,7-tetraen-9-one
Conditions | Yield |
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With toluene-4-sulfonic acid In ethanol; water for 10h; Reflux; | 65.8% |
6-fluoro-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4(13),5,7-tetraen-9-one
Conditions | Yield |
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With 10% Pt/activated carbon; hydrogen In methanol at 20℃; for 6h; Time; | 1.2 g |
3-fluoro-5-nitrobenzoic acid
6-fluoro-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4(13),5,7-tetraen-9-one
Conditions | Yield |
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Multi-step reaction with 6 steps 1: N-chloro-succinimide / N,N-dimethyl-formamide / 4 h / 35 °C 2: tetrahydrofuran / 1 h / -30 °C 3: thionyl chloride / 4 h / 0 - 30 °C 4: trichlorophosphate / 2.67 h / 60 °C / Cooling with ice 5: ammonium acetate / 3.5 h / 60 °C 6: 10% Pt/activated carbon; hydrogen / methanol / 6 h / 20 °C View Scheme |