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90666-72-1

90666-72-1 structural image
Product Name: 2-(10-OXO-10H-1,4A,9-TRIAZA-ANTHRACEN-2-YLAMINO)-BENZOIC ACID
Formula: C18H12N4O3
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COMPUTED DESCRIPTORS

Molecular Weight 332.3 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 332.09094026 g/mol
Monoisotopic Mass 332.09094026 g/mol
Topological Polar Surface Area 94.4 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 669
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