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477886-67-2

477886-67-2 structural image
Product Name: 6-METHYL-1-(3-NITROANILINO)-4-OXO-1,4-DIHYDRO-3-PYRIDINECARBOXYLIC ACID
Formula: C13H11N3O5
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COMPUTED DESCRIPTORS

Molecular Weight 289.24 g/mol
XLogP3 2.6
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 3
Exact Mass 289.06987046 g/mol
Monoisotopic Mass 289.06987046 g/mol
Topological Polar Surface Area 116 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 534
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