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52018-85-6 | 3-[pyridin-2-yl(pyridin-2-ylhydrazono)methyl]benzenesulphonic acid
CAS No: 52018-85-6 Catalog No: AG00E273 MDL No:
Product Description
Catalog Number:
AG00E273
Chemical Name:
3-[pyridin-2-yl(pyridin-2-ylhydrazono)methyl]benzenesulphonic acid
CAS Number:
52018-85-6
IUPAC Name:
3-[(E)-C-pyridin-2-yl-N-(pyridin-2-ylamino)carbonimidoyl]benzenesulfonic acid
InChI:
InChI=1S/C17H14N4O3S/c22-25(23,24)14-7-5-6-13(12-14)17(15-8-1-3-10-18-15)21-20-16-9-2-4-11-19-16/h1-12H,(H,19,20)(H,22,23,24)/b21-17+
InChI Key:
RFBIFVJURBNJJY-HEHNFIMWSA-N
EC Number:
257-609-1
NSC Number:
326194
Properties
Complexity:
561
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
354.079g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
354.384g/mol
Monoisotopic Mass:
354.079g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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