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72207-76-2 | Iron, complexes with coupled 1-(2,4-dihydroxyphenyl)ethanone-7-nitronaphth1,2-d1,2,3oxadiazole-5-sulfonic acid
CAS No: 72207-76-2 Catalog No: AG00FT6D MDL No:
Product Description
Catalog Number:
AG00FT6D
Chemical Name:
Iron, complexes with coupled 1-(2,4-dihydroxyphenyl)ethanone-7-nitronaphth1,2-d1,2,3oxadiazole-5-sulfonic acid
CAS Number:
72207-76-2
IUPAC Name:
1-(2,4-dihydroxyphenyl)ethanone;iron;7-nitrobenzo[e][1,2,3]benzoxadiazole-5-sulfonic acid
InChI:
InChI=1S/C10H5N3O6S.C8H8O3.Fe/c14-13(15)5-1-2-6-7(3-5)9(20(16,17)18)4-8-10(6)11-12-19-8;1-5(9)7-3-2-6(10)4-8(7)11;/h1-4H,(H,16,17,18);2-4,10-11H,1H3;
InChI Key:
USERJNPNXVCUMF-UHFFFAOYSA-N
Properties
Complexity:
656
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
502.972g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
11
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
503.219g/mol
Monoisotopic Mass:
502.972g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
205A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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