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89033-17-0

89033-17-0 structural image
Product Name: isothiazol-3-ylMethanol
Formula: C4H5NOS
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COMPUTED DESCRIPTORS

Molecular Weight 115.16 g/mol
XLogP3 0.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 115.00918496 g/mol
Monoisotopic Mass 115.00918496 g/mol
Topological Polar Surface Area 61.4 Ų
Heavy Atom Count 7
Formal Charge 0
Complexity 59.7
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