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847644-97-7

847644-97-7 structural image
Product Name: (S)-N-(2-isocyanato-3,3-diMethylbutyl)-N-MethylMethanesulfonaMide
Formula: C9H18N2O3S
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COMPUTED DESCRIPTORS

Molecular Weight 234.32 g/mol
XLogP3 2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 5
Exact Mass 234.10381361 g/mol
Monoisotopic Mass 234.10381361 g/mol
Topological Polar Surface Area 75.2 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 345
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes