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946-13-4

946-13-4 structural image
Product Name: 6-METHOXYBENZOTHIAZOLE-2-CARBOXYLIC ACID
Formula: C9H7NO3S
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COMPUTED DESCRIPTORS

Molecular Weight 209.22 g/mol
XLogP3 2.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 209.01466426 g/mol
Monoisotopic Mass 209.01466426 g/mol
Topological Polar Surface Area 87.7 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 236
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