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64550-88-5

64550-88-5 structural image
Product Name: SINIGRIN MONOHYDRATE
Formula: C10H18KNO10S2
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COMPUTED DESCRIPTORS

Molecular Weight 358.4 g/mol
XLogP3 -1.1
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 11
Rotatable Bond Count 6
Exact Mass 358.02664844 g/mol
Monoisotopic Mass 358.02664844 g/mol
Topological Polar Surface Area 203 Ų
Heavy Atom Count 22
Formal Charge -1
Complexity 490
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 5
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 1
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes