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2060060-53-7

2060060-53-7 structural image
Product Name: 5-Oxaspiro[2.5]octane-8-carbothioamide
Formula: C8H13NOS
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COMPUTED DESCRIPTORS

Molecular Weight 171.26 g/mol
XLogP3 0.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 171.07178521 g/mol
Monoisotopic Mass 171.07178521 g/mol
Topological Polar Surface Area 67.3 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 189
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes