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120279-86-9

120279-86-9 structural image
Product Name: 5,6-DIHYDRO-6-METHYL-4-OXO-4H-THIENO[2,3-B]THIOPYRAN-2-SULFONIC ACIS
Formula: C8H8O4S3
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COMPUTED DESCRIPTORS

Molecular Weight 264.3 g/mol
XLogP3 1.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 1
Exact Mass 263.95847225 g/mol
Monoisotopic Mass 263.95847225 g/mol
Topological Polar Surface Area 133 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 372
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