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764661-25-8

764661-25-8 structural image
Product Name: 3-(NICOTINOYL-2,4,5,6-D4)-2-PYRROLIDINONE
Formula: C10H6D4N2O2
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COMPUTED DESCRIPTORS

Molecular Weight 194.22 g/mol
XLogP3 0.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 194.099334550 g/mol
Monoisotopic Mass 194.099334550 g/mol
Topological Polar Surface Area 59.1 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 253
Isotope Atom Count 4
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes