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3683-98-5

3683-98-5 structural image
Product Name: 5-Isothiazolecarboxamide
Formula: C4H4N2OS
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COMPUTED DESCRIPTORS

Molecular Weight 128.15 g/mol
XLogP3 0.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 128.00443393 g/mol
Monoisotopic Mass 128.00443393 g/mol
Topological Polar Surface Area 84.2 Ų
Heavy Atom Count 8
Formal Charge 0
Complexity 106
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