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26644-96-2 | 1-Naphthalenesulfonicacid, 4-[2-(8-hydroxy-5-quinolinyl)diazenyl]-
CAS No: 26644-96-2 Catalog No: AG007KXM MDL No:
Product Description
Catalog Number:
AG007KXM
Chemical Name:
1-Naphthalenesulfonicacid, 4-[2-(8-hydroxy-5-quinolinyl)diazenyl]-
CAS Number:
26644-96-2
Molecular Formula:
C19H13N3O4S
Molecular Weight:
379.3892
IUPAC Name:
4-[(8-hydroxyquinolin-5-yl)diazenyl]naphthalene-1-sulfonic acid
InChI:
InChI=1S/C19H13N3O4S/c23-17-9-7-16(14-6-3-11-20-19(14)17)22-21-15-8-10-18(27(24,25)26)13-5-2-1-4-12(13)15/h1-11,23H,(H,24,25,26)
InChI Key:
HQNCDPDGDRMZOI-UHFFFAOYSA-N
SMILES:
Oc1ccc(c2c1nccc2)N=Nc1ccc(c2c1cccc2)S(=O)(=O)O
Properties
Complexity:
650
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
379.063g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
379.39g/mol
Monoisotopic Mass:
379.063g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
121A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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