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6943-17-5

6943-17-5 structural image
Product Name: 6-NITROQUINAZOLIN-4(3H)-ONE
Formula: C8H5N3O3
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility >28.7 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 191.14 g/mol
XLogP3 0.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 0
Exact Mass 191.03309103 g/mol
Monoisotopic Mass 191.03309103 g/mol
Topological Polar Surface Area 87.3 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 297
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