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53603-16-0

53603-16-0 structural image
Product Name: HEXYL METHANETHIOSULFONATE
Formula: C7H16O2S2
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COMPUTED DESCRIPTORS

Molecular Weight 196.3 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 6
Exact Mass 196.05917210 g/mol
Monoisotopic Mass 196.05917210 g/mol
Topological Polar Surface Area 67.8 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 167
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