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56282-36-1

56282-36-1 structural image
Product Name: 3,6-DIOXA-8-MERCAPTOOCTAN-1-OL
Formula: C6H14O3S
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COMPUTED DESCRIPTORS

Molecular Weight 166.24 g/mol
XLogP3 -0.6
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 7
Exact Mass 166.06636548 g/mol
Monoisotopic Mass 166.06636548 g/mol
Topological Polar Surface Area 39.7 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 61
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