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16063-05-1

16063-05-1 structural image
Product Name: 2-(4-Nitrophenyl)-4H-3,1-benzoxazin-4-one
Formula: C14H8N2O4
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 0.3 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 268.22 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 1
Exact Mass 268.04840674 g/mol
Monoisotopic Mass 268.04840674 g/mol
Topological Polar Surface Area 84.5 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 435
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