200,000+ products from a single source!
sales@angenechem.com
Home > Quinoline > 128397-41-1
128397-41-1 | 4H-Bis[1,3]benzodioxolo[5,6-a:4',5'-g]quinolizinium, 6,7,12b,13-tetrahydro-12b-hydroxy-5-methyl-
CAS No: 128397-41-1 Catalog No: AG000Y26 MDL No:MFCD20260978
Product Description
Catalog Number:
AG000Y26
Chemical Name:
4H-Bis[1,3]benzodioxolo[5,6-a:4',5'-g]quinolizinium, 6,7,12b,13-tetrahydro-12b-hydroxy-5-methyl-
CAS Number:
128397-41-1
Molecular Formula:
C20H20NO5+
Molecular Weight:
354.3765
MDL Number:
MFCD20260978
IUPAC Name:
13-methyl-5,7,17,19-tetraoxa-13-azoniahexacyclo[11.11.0.02,10.04,8.015,23.016,20]tetracosa-2,4(8),9,15(23),16(20),21-hexaen-1-ol
InChI:
InChI=1S/C20H20NO5/c1-21-5-4-12-6-17-18(25-10-24-17)7-15(12)20(21,22)8-13-2-3-16-19(14(13)9-21)26-11-23-16/h2-3,6-7,22H,4-5,8-11H2,1H3/q+1
InChI Key:
SZMZXQWCICMUFH-UHFFFAOYSA-N
SMILES:
C[N+]12CCc3c(C2(O)Cc2c(C1)c1OCOc1cc2)cc1c(c3)OCO1
Properties
Complexity:
589
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
354.134g/mol
Formal Charge:
1
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
354.382g/mol
Monoisotopic Mass:
354.134g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
57.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.