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15401-69-1

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Basic Information

Molecular Structure:
CAS No.:	15401-69-1
Name:	berberrubine
Article Data:	80

Formula:	C19H16 N O4 . Cl
Molecular Weight:	357.793
Synonyms:	Benzo[g]-1,3-benzodioxolo[5,6-a]quinolizinium,5,6-dihydro-9-hydroxy-10-methoxy-, chloride (9CI); Berbinium,7,8,13,13a-tetradehydro-9-hydroxy-10-methoxy-2,3-(methylenedioxy)-, chloride(8CI); 9-Berberoline chloride; 9-Demethoxy-9-hydroxyberberinium chloride;Berberrubine chloride; Beroline chloride
Density:	g/cm³
Melting Point:	245℃ (DEC.)
Boiling Point:	°Cat760mmHg
Flash Point:	°C
PSA:	51.80000
LogP:	-0.20270

Synthetic route

: 108275-17-8, 6847-93-4
berberrubine

: 15401-69-1
berberrubine chloride

Conditions	Yield
With hydrogenchloride In ethanol; water at 20℃; for 8h;	98%
With hydrogenchloride In chloroform Ambient temperature;	94.1%
With hydrogenchloride In ethanol; water pH=5 - 6;	82%
With hydrogenchloride In water
With hydrogenchloride In ethanol at 20℃;

: 633-65-8
berberine chloride

: 15401-69-1
berberrubine chloride

Conditions	Yield
at 180℃; for 0.333333h;	98%
In N,N-dimethyl-formamide at 160℃;	94%
at 190℃; for 0.333333h;	93.92%

: 17388-19-1
berberrubine

: 15401-69-1
berberrubine chloride

Conditions	Yield
With hydrogenchloride In water; acetonitrile at 20℃; for 3h;	90%

: 68030-18-2
berberine chloride hydrate

: 15401-69-1
berberrubine chloride

Conditions	Yield
at 190℃; under 20 - 30 Torr; for 2h; Calcination;	80%

: 9-O-(2,4-dinitrobenzenesulfonyl)berberrubine

: 15401-69-1
berberrubine chloride

Conditions	Yield
With sulfide ion In aq. buffer pH=7.2;

: C19H16NO4(1+)*HO(1-)

: 15401-69-1
berberrubine chloride

Conditions	Yield
With hydrogenchloride In water Cooling;
With hydrogenchloride In water

: 148-53-8
3-methoxy-2-hydroxybenzaldehyde

: 15401-69-1
berberrubine chloride

Conditions	Yield
Multi-step reaction with 4 steps 1.1: 0.5 h / 70 - 95 °C / 712.57 Torr / Autoclave 2.1: hydrogen / 0.83 h / 70 - 115 °C / 22502.3 - 30003 Torr / Autoclave 3.1: hydrogenchloride / water / Cooling 3.2: 2 h / 85 - 120 °C 3.3: 0.67 h / 85 - 90 °C 4.1: hydrogenchloride / water / Cooling View Scheme
Multi-step reaction with 4 steps 1.1: 70 - 95 °C / Autoclave 2.1: hydrogen / 0.83 h / 70 - 115 °C / Autoclave; High pressure 3.1: hydrogenchloride / water / 70 - 90 °C 3.2: 2 h / 85 - 120 °C 3.3: 85 °C 4.1: hydrogenchloride / water View Scheme
Multi-step reaction with 4 steps 1.1: 0.5 h / 70 - 95 °C / 712.57 Torr / Autoclave 2.1: hydrogen / 0.83 h / 70 - 115 °C / 22502.3 - 30003 Torr / Autoclave 3.1: hydrogenchloride / 20 °C 4.1: copper dichloride / 2 h / 85 - 120 °C 4.2: 0.67 h / 85 °C View Scheme

: 1484-85-1
3,4-methylenedioxyphenylethylamine

: 15401-69-1
berberrubine chloride

Conditions	Yield
Multi-step reaction with 4 steps 1.1: 0.5 h / 70 - 95 °C / 712.57 Torr / Autoclave 2.1: hydrogen / 0.83 h / 70 - 115 °C / 22502.3 - 30003 Torr / Autoclave 3.1: hydrogenchloride / water / Cooling 3.2: 2 h / 85 - 120 °C 3.3: 0.67 h / 85 - 90 °C 4.1: hydrogenchloride / water / Cooling View Scheme
Multi-step reaction with 4 steps 1.1: 70 - 95 °C / Autoclave 2.1: hydrogen / 0.83 h / 70 - 115 °C / Autoclave; High pressure 3.1: hydrogenchloride / water / 70 - 90 °C 3.2: 2 h / 85 - 120 °C 3.3: 85 °C 4.1: hydrogenchloride / water View Scheme
Multi-step reaction with 4 steps 1.1: 0.5 h / 70 - 95 °C / 712.57 Torr / Autoclave 2.1: hydrogen / 0.83 h / 70 - 115 °C / 22502.3 - 30003 Torr / Autoclave 3.1: hydrogenchloride / 20 °C 4.1: copper dichloride / 2 h / 85 - 120 °C 4.2: 0.67 h / 85 °C View Scheme

: 880344-81-0
2-{[(E)-2-Benzo[1,3]dioxol-5-yl-ethylimino]-methyl}-6-methoxy-phenol

: 15401-69-1
berberrubine chloride

Conditions	Yield
Multi-step reaction with 3 steps 1.1: hydrogen / 0.83 h / 70 - 115 °C / 22502.3 - 30003 Torr / Autoclave 2.1: hydrogenchloride / water / Cooling 2.2: 2 h / 85 - 120 °C 2.3: 0.67 h / 85 - 90 °C 3.1: hydrogenchloride / water / Cooling View Scheme
Multi-step reaction with 3 steps 1.1: hydrogen / 0.83 h / 70 - 115 °C / Autoclave; High pressure 2.1: hydrogenchloride / water / 70 - 90 °C 2.2: 2 h / 85 - 120 °C 2.3: 85 °C 3.1: hydrogenchloride / water View Scheme
Multi-step reaction with 3 steps 1.1: hydrogen / 0.83 h / 70 - 115 °C / 22502.3 - 30003 Torr / Autoclave 2.1: hydrogenchloride / 20 °C 3.1: copper dichloride / 2 h / 85 - 120 °C 3.2: 0.67 h / 85 °C View Scheme

: 274-09-9
Methylenedioxybenzene

: 15401-69-1
berberrubine chloride

Conditions	Yield
Multi-step reaction with 5 steps 1.1: ethyl acetate / 8 h 2.1: 70 - 95 °C / Autoclave 3.1: hydrogen / 0.83 h / 70 - 115 °C / Autoclave; High pressure 4.1: hydrogenchloride / water / 70 - 90 °C 4.2: 2 h / 85 - 120 °C 4.3: 85 °C 5.1: hydrogenchloride / water View Scheme
Multi-step reaction with 5 steps 1.1: ethyl acetate / 8 h 2.1: 0.5 h / 70 - 95 °C / 712.57 Torr / Autoclave 3.1: hydrogen / 0.83 h / 70 - 115 °C / 22502.3 - 30003 Torr / Autoclave 4.1: hydrogenchloride / 20 °C 5.1: copper dichloride / 2 h / 85 - 120 °C 5.2: 0.67 h / 85 °C View Scheme

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