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89852-45-9

89852-45-9 structural image
Product Name: 5-PENTYLTHIO-1,3,4-THIADIAZOLE-2-THIOL
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COMPUTED DESCRIPTORS

Molecular Weight 220.4 g/mol
XLogP3 3.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 5
Exact Mass 220.01626191 g/mol
Monoisotopic Mass 220.01626191 g/mol
Topological Polar Surface Area 107 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 191
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