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129679-51-2

129679-51-2 structural image
Product Name: 1,4-Ethano-1H,3H-thieno(3,4-c)thiophen-3-one, tetrahydro-6-thioxo-
Formula: C8H8OS3
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COMPUTED DESCRIPTORS

Molecular Weight 216.4 g/mol
XLogP3 1.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 0
Exact Mass 215.97372840 g/mol
Monoisotopic Mass 215.97372840 g/mol
Topological Polar Surface Area 99.8 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 276
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 4
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes