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912578-71-3

912578-71-3 structural image
Product Name: tetrahydro-2H-thiopyran-4-carbonitrile 1,1-dioxide(SALTDATA: FREE)
Formula: C6H9NO2S
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COMPUTED DESCRIPTORS

Molecular Weight 159.21 g/mol
XLogP3 -0.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 0
Exact Mass 159.03539970 g/mol
Monoisotopic Mass 159.03539970 g/mol
Topological Polar Surface Area 66.3 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 239
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