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86271-56-9 | 3-Pyridinol, 2,6-diamino-5-(phenylazo)-
CAS No: 86271-56-9 Catalog No: AG004JH5 MDL No:
Product Description
Catalog Number:
AG004JH5
Chemical Name:
3-Pyridinol, 2,6-diamino-5-(phenylazo)-
CAS Number:
86271-56-9
Molecular Formula:
C11H11N5O
Molecular Weight:
229.2379
IUPAC Name:
2,6-diamino-5-phenyldiazenylpyridin-3-ol
InChI:
InChI=1S/C11H11N5O/c12-10-8(6-9(17)11(13)14-10)16-15-7-4-2-1-3-5-7/h1-6,17H,(H4,12,13,14)
InChI Key:
BVBZFKYOQZLANE-UHFFFAOYSA-N
SMILES:
Nc1nc(N)c(cc1N=Nc1ccccc1)O
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.096g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
229.243g/mol
Monoisotopic Mass:
229.096g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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