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872726-53-9

872726-53-9 structural image
Product Name: BENZOTHIAZOLE, 2-(3,4-DIMETHOXYPHENYL)-6-FLUORO-
Formula: C15H12FNO2S
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COMPUTED DESCRIPTORS

Molecular Weight 289.3 g/mol
XLogP3 4.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 289.05727796 g/mol
Monoisotopic Mass 289.05727796 g/mol
Topological Polar Surface Area 59.6 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 333
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