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67389-43-9 | 1-Naphthalenesulfonamide, 6-diazo-5,6-dihydro-N-(4-hydroxyphenyl)-5-oxo-
CAS No: 67389-43-9 Catalog No: AG005OQM MDL No:
Product Description
Catalog Number:
AG005OQM
Chemical Name:
1-Naphthalenesulfonamide, 6-diazo-5,6-dihydro-N-(4-hydroxyphenyl)-5-oxo-
CAS Number:
67389-43-9
Molecular Formula:
C16H11N3O4S
Molecular Weight:
341.3412
IUPAC Name:
2-diazonio-5-[(4-hydroxyphenyl)sulfamoyl]naphthalen-1-olate
InChI:
InChI=1S/C16H11N3O4S/c17-18-14-9-8-12-13(16(14)21)2-1-3-15(12)24(22,23)19-10-4-6-11(20)7-5-10/h1-9,17,21H
InChI Key:
NDPMPBXUADOJEQ-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=C1C=Cc2c(C1=O)cccc2S(=O)(=O)Nc1ccc(cc1)O
Properties
Complexity:
588
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.047g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
341.341g/mol
Monoisotopic Mass:
341.047g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
126A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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