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98589-45-8

98589-45-8 structural image
Product Name: 6-Benzothiazoleaceticacid(6CI,9CI)
Formula: C9H7NO2S
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COMPUTED DESCRIPTORS

Molecular Weight 193.22 g/mol
XLogP3 1.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 193.01974964 g/mol
Monoisotopic Mass 193.01974964 g/mol
Topological Polar Surface Area 78.4 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 210
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