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62566-60-3 | 3,5-Pyridinediol,1-oxide(9CI)
CAS No: 62566-60-3 Catalog No: AG00F5EZ MDL No:
Product Description
Catalog Number:
AG00F5EZ
Chemical Name:
3,5-Pyridinediol,1-oxide(9CI)
CAS Number:
62566-60-3
IUPAC Name:
1-oxidopyridin-1-ium-3,5-diol
InChI:
InChI=1S/C5H5NO3/c7-4-1-5(8)3-6(9)2-4/h1-3,7-8H
InChI Key:
NUVWNIAGMVQUGZ-UHFFFAOYSA-N
Properties
Complexity:
88.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.027g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
127.099g/mol
Monoisotopic Mass:
127.027g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
65.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9
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