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26238-00-6 | Pyridazino[4,3-c:5,6-c']diquinoline, 5,8,13-trioxide (8CI,9CI)
CAS No: 26238-00-6 Catalog No: AG002SEY MDL No:
Product Description
Catalog Number:
AG002SEY
Chemical Name:
Pyridazino[4,3-c:5,6-c']diquinoline, 5,8,13-trioxide (8CI,9CI)
CAS Number:
26238-00-6
Molecular Formula:
C18H10N4O3
Molecular Weight:
330.2970
IUPAC Name:
12,21-dioxido-13,21-diaza-4,12-diazoniapentacyclo[12.8.0.02,11.05,10.015,20]docosa-1(22),2,5,7,9,11,13,15,17,19-decaene 4-oxide
InChI:
InChI=1S/C18H10N4O3/c23-20-9-13-14-10-21(24)16-8-4-2-6-12(16)18(14)22(25)19-17(13)11-5-1-3-7-15(11)20/h1-10H
InChI Key:
QPZQABMPUPIRGH-UHFFFAOYSA-N
SMILES:
[O-][n+]1cc2c(c3c1cccc3)n[n+](c1c2c[n+]([O-])c2c1cccc2)[O-]
Properties
Complexity:
766
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.075g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
330.303g/mol
Monoisotopic Mass:
330.075g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
87.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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