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135980-47-1

135980-47-1 structural image
Product Name: 4-(1,3-DIOXO-1H,3H-BENZO[DE]ISOQUINOLIN-2-YL)-BENZOIC ACID
Formula: C19H11NO4
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility >47.6 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 317.3 g/mol
XLogP3 3.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 317.06880783 g/mol
Monoisotopic Mass 317.06880783 g/mol
Topological Polar Surface Area 74.7 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 522
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