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872706-93-9

872706-93-9 structural image
Product Name: (2-cyanopyridin-4-yl)methyl methanesulfonate
Formula: C8H8N2O3S
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COMPUTED DESCRIPTORS

Molecular Weight 212.23 g/mol
XLogP3 0.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 212.02556330 g/mol
Monoisotopic Mass 212.02556330 g/mol
Topological Polar Surface Area 88.4 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 324
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