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7465-66-9

7465-66-9 structural image
Product Name: 1-METHYL-2,4-DIOXO-1,2,3,4-TETRAHYDRO-5-PYRIMIDINECARBONITRILE
Formula: C6H5N3O2
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COMPUTED DESCRIPTORS

Molecular Weight 151.12 g/mol
XLogP3 -0.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 0
Exact Mass 151.038176411 g/mol
Monoisotopic Mass 151.038176411 g/mol
Topological Polar Surface Area 73.2 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 296
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