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289913-88-8

289913-88-8 structural image
Product Name: 2-[4-(METHYLAMINO)-3-NITROBENZOYL]BENZOIC ACID
Formula: C15H12N2O5
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility >45 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 300.27 g/mol
XLogP3 3.2
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 300.07462149 g/mol
Monoisotopic Mass 300.07462149 g/mol
Topological Polar Surface Area 112 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 448
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