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4858-29-1

4858-29-1 structural image
Product Name: 5-OCTYLTHIO-1,3,4-THIADIAZOLE-2-THIOL
Formula: C10H18N2S3
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COMPUTED DESCRIPTORS

Molecular Weight 262.5 g/mol
XLogP3 5.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 8
Exact Mass 262.06321210 g/mol
Monoisotopic Mass 262.06321210 g/mol
Topological Polar Surface Area 107 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 229
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