Substance
- Substance Name: berberine chloride
- Formula: C20H18ClNO4
- Molecular Weight: 371.8 g/mol
- Identifiers:
- casrn: 633-65-8
- pubchemId: 12456
- inchi: InChI=1S/C20H18NO4.ClH/c1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2;/h3-4,7-10H,5-6,11H2,1-2H3;1H/q+1;/p-1
- inchikey: VKJGBAJNNALVAV-UHFFFAOYSA-M
- csmiles: COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC5=C(C=C4CC3)OCO5)OC.[Cl-]
- ismiles: COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC5=C(C=C4CC3)OCO5)OC.[Cl-]
- iupacname: 16,17-dimethoxy-5,7-dioxa-13-azoniapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(13),2,4(8),9,14,16,18,20-octaene;chloride
- wikidataId: Q72443278
- dsstoxcmpId: DTXCID404602
- ecnumber: 211-195-9
berberine chloride
Systems and Datasets
- berberine chloride (Datasets: 2)
- Dataset 1 in paper 10.1021/je0504360 (Dataseries: 1, Datapoints: 1, Quantity: Molar enthalpy of transition or fusion)
- Dataset 2 in paper 10.1021/je0504360 (Dataseries: 1, Datapoints: 1, Quantity: Normal melting temperature)
- 1-butanol + berberine chloride (Datasets: 1)
- Dataset 5 in paper 10.1021/je0504360 (Dataseries: 1, Datapoints: 4, Quantity: Mole fraction)
- 1-octanol + berberine chloride (Datasets: 1)
- Dataset 6 in paper 10.1021/je0504360 (Dataseries: 1, Datapoints: 4, Quantity: Mole fraction)
- 9,10-dimethoxy-5,6-dihydro[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolinium chloride + 1-ethyl-3-methylimidazolium tetrafluoroborate (Datasets: 1)
- Dataset 1 in paper 10.1021/acs.jced.5b01017 (Dataseries: 1, Datapoints: 6, Quantity: Mole fraction)
- 9,10-dimethoxy-5,6-dihydro[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolinium chloride + 1-butyl-3-methylimidazolium tetrafluoroborate (Datasets: 1)
- Dataset 2 in paper 10.1021/acs.jced.5b01017 (Dataseries: 1, Datapoints: 7, Quantity: Mole fraction)
- 9,10-dimethoxy-5,6-dihydro[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolinium chloride + 1-hexyl-3-methylimidazolium tetrafluoroborate (Datasets: 1)
- Dataset 3 in paper 10.1021/acs.jced.5b01017 (Dataseries: 1, Datapoints: 8, Quantity: Mole fraction)
- 9,10-dimethoxy-5,6-dihydro[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolinium chloride + 1-methyl-3-octylimidazolium tetrafluoroborate (Datasets: 1)
- Dataset 4 in paper 10.1021/acs.jced.5b01017 (Dataseries: 1, Datapoints: 9, Quantity: Mole fraction)
- 9,10-dimethoxy-5,6-dihydro[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolinium chloride + 1-butyl-3-methylimidazolium nitrate (Datasets: 1)
- Dataset 5 in paper 10.1021/acs.jced.5b01017 (Dataseries: 1, Datapoints: 11, Quantity: Mole fraction)
- 9,10-dimethoxy-5,6-dihydro[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolinium chloride + 1-hexyl-3-methylimidazolium nitrate (Datasets: 1)
- Dataset 6 in paper 10.1021/acs.jced.5b01017 (Dataseries: 1, Datapoints: 9, Quantity: Mole fraction)
- 9,10-dimethoxy-5,6-dihydro[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolinium chloride + 1-methyl-3-octylimidazolium nitrate (Datasets: 1)
- Dataset 7 in paper 10.1021/acs.jced.5b01017 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- 9,10-dimethoxy-5,6-dihydro[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolinium chloride + 1-butyl-3-methylimidazolium hexafluorophosphate (Datasets: 1)
- Dataset 8 in paper 10.1021/acs.jced.5b01017 (Dataseries: 1, Datapoints: 5, Quantity: Mole fraction)
- 9,10-dimethoxy-5,6-dihydro[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolinium chloride + 1-hexyl-3-methylimidazolium hexafluorophosphate (Datasets: 1)
- Dataset 9 in paper 10.1021/acs.jced.5b01017 (Dataseries: 1, Datapoints: 5, Quantity: Mole fraction)
- 9,10-dimethoxy-5,6-dihydro[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolinium chloride + 1-octyl-3-methylimidazolium hexafluorophosphate (Datasets: 1)
- Dataset 10 in paper 10.1021/acs.jced.5b01017 (Dataseries: 1, Datapoints: 6, Quantity: Mole fraction)
- 9,10-dimethoxy-5,6-dihydro[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolinium chloride + 1-butyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide (Datasets: 1)
- Dataset 11 in paper 10.1021/acs.jced.5b01017 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- 9,10-dimethoxy-5,6-dihydro[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolinium chloride + 1-hexyl-3-methylimidazolium bis[(trifluoromethyl)sulfonyl]imide (Datasets: 1)
- Dataset 12 in paper 10.1021/acs.jced.5b01017 (Dataseries: 1, Datapoints: 9, Quantity: Mole fraction)
- 9,10-dimethoxy-5,6-dihydro[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolinium chloride + 1-octyl-3-methylimidazolium bis[(trifluoromethyl)sulfonyl]imide (Datasets: 1)
- Dataset 13 in paper 10.1021/acs.jced.5b01017 (Dataseries: 1, Datapoints: 8, Quantity: Mole fraction)
- ethanol + 9,10-dimethoxy-5,6-dihydro[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolinium chloride (Datasets: 1)
- Dataset 3 in paper 10.1021/je0504360 (Dataseries: 1, Datapoints: 4, Quantity: Mole fraction)
- propan-2-ol + 9,10-dimethoxy-5,6-dihydro[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolinium chloride (Datasets: 1)
- Dataset 4 in paper 10.1021/je0504360 (Dataseries: 1, Datapoints: 4, Quantity: Mole fraction)
- ethanol + propan-2-ol + 9,10-dimethoxy-5,6-dihydro[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolinium chloride (Datasets: 1)
- Dataset 7 in paper 10.1021/je0504360 (Dataseries: 1, Datapoints: 16, Quantity: Mole fraction)
- ethanol + butan-1-ol + 9,10-dimethoxy-5,6-dihydro[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolinium chloride (Datasets: 1)
- Dataset 8 in paper 10.1021/je0504360 (Dataseries: 3, Datapoints: 12, Quantity: Mole fraction)
- ethanol + octan-1-ol + 9,10-dimethoxy-5,6-dihydro[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolinium chloride (Datasets: 1)
- Dataset 9 in paper 10.1021/je0504360 (Dataseries: 3, Datapoints: 12, Quantity: Mole fraction)