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Home > Pyridines > 116333-49-4
116333-49-4 | [2,2'-Bipyridine]-4,4'-diol, 1,1'-dioxide
CAS No: 116333-49-4 Catalog No: AG000C7Y MDL No:
Product Description
Catalog Number:
AG000C7Y
Chemical Name:
[2,2'-Bipyridine]-4,4'-diol, 1,1'-dioxide
CAS Number:
116333-49-4
Molecular Formula:
C10H8N2O4
Molecular Weight:
220.1815
IUPAC Name:
1-hydroxy-2-(1-hydroxy-4-oxopyridin-2-yl)pyridin-4-one
InChI:
InChI=1S/C10H8N2O4/c13-7-1-3-11(15)9(5-7)10-6-8(14)2-4-12(10)16/h1-6,15-16H
InChI Key:
IAVHGEWSDZWDEO-UHFFFAOYSA-N
SMILES:
Oc1cc[n+](c(c1)c1cc(O)cc[n+]1[O-])[O-]
Properties
Complexity:
429
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.048g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
220.184g/mol
Monoisotopic Mass:
220.048g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
81.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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