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81-78-7

81-78-7 structural image
Product Name: 2,2'-[(9,10-dihydro-9,10-dioxo-1,5-anthrylene)diimino]bisbenzoic acid
Formula: C28H18N2O6
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COMPUTED DESCRIPTORS

Molecular Weight 478.5 g/mol
XLogP3 6.1
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 6
Exact Mass 478.11648630 g/mol
Monoisotopic Mass 478.11648630 g/mol
Topological Polar Surface Area 133 Ų
Heavy Atom Count 36
Formal Charge 0
Complexity 806
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

2-[[5-(2-carboxyanilino)-9,10-dioxo-1-anthracenyl]amino]benzoic acid is an anthraquinone.