Cas no 117-74-8 (Benzo[g]-1,3-benzodioxolo[5,6-a]quinolizinium,5,6-dihydro-9,10-dimethoxy-, hydroxide (1:1))
117-74-8 structure
Product Name:Benzo[g]-1,3-benzodioxolo[5,6-a]quinolizinium,5,6-dihydro-9,10-dimethoxy-, hydroxide (1:1)
Benzo[g]-1,3-benzodioxolo[5,6-a]quinolizinium,5,6-dihydro-9,10-dimethoxy-, hydroxide (1:1) Chemical and Physical Properties
Names and Identifiers
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- Benzo[g]-1,3-benzodioxolo[5,6-a]quinolizinium,5,6-dihydro-9,10-dimethoxy-, hydroxide (1:1)
- Benzog-1,3-benzodioxolo5,6-aquinolizinium, 5,6-dihydro-9,10-dimethoxy-, hydroxide
- Berberine hydroxide
- 9,10-dimethoxy-5,6-dihydro[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ium hydroxide
- C.I. Natural Yellow 18
- 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;hydroxide
- Benzo(g)-1,3-benzodioxolo(5,6-a)quinolizinium, 5,6-dihydro-9,10-dimethoxy-, hydroxide
- DTXSID50151657
- Dar hald
- Daru hald
- Assam wood
- Berbinium, 7,8,13,13a-tetradehydro-9,10-dimethoxy-2,3-(methylenedioxy)-, hydroxide
- SCHEMBL10709599
- 117-74-8
- Benzo[g]-1,3-benzodioxolo[5,6-a]quinolizinium, 5,6-dihydro-9,10-dimethoxy-, hydroxide (1:1)
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- Inchi: 1S/C20H18NO4.H2O/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;1H2/q+1;/p-1
- InChI Key: GMMNRSJSVLUGRV-UHFFFAOYSA-M
- SMILES: O1COC2C1=CC1=C(C=2)C2C=C3C=CC(=C(C3=C[N+]=2CC1)OC)OC.[OH-]
Computed Properties
- Exact Mass: 353.12637
- Monoisotopic Mass: 353.126
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 26
- Rotatable Bond Count: 2
- Complexity: 488
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 41.8A^2
Experimental Properties
- Boiling Point: °Cat760mmHg
- Flash Point: °C
- PSA: 70.8
Benzo[g]-1,3-benzodioxolo[5,6-a]quinolizinium,5,6-dihydro-9,10-dimethoxy-, hydroxide (1:1) Security Information
- Hazardous Material transportation number:1544
- HazardClass:6.1(b)
- PackingGroup:III
Benzo[g]-1,3-benzodioxolo[5,6-a]quinolizinium,5,6-dihydro-9,10-dimethoxy-, hydroxide (1:1) Related Literature
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Remir G. Kostyanovsky,Yury I. El'natanov,Oleg N. Krutius,Konstantin A. Lyssenko,Ivan I. Chervin,Denis A. Lenev Mendeleev Commun. 1999 9 109
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Peter G. Edwards,Benson M. Kariuki,Paul D. Newman,Huw A. Tallis,Craig Williams Dalton Trans. 2014 43 15532
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Nicholas Bakewell,Rumintha Thavarajah,Majid Motevalli,Tippu S. Sheriff New J. Chem. 2017 41 15411
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Andrew D. Burrows,Kevin Cassar,Tina Düren,Richard M. W. Friend,Mary F. Mahon,Sean P. Rigby,Teresa L. Savarese Dalton Trans. 2008 2465
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5. Synthesis and reactivity of the ferrocene-derived phosphine [Fe(η-C5H5){η-C5H4CH2P(CH2OH)2}]Nicholas J. Goodwin,William Henderson,Brian K. Nicholson,J. Kwabena Sarfo,John Fawcett,David R. Russell J. Chem. Soc. Dalton Trans. 1997 4377
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