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22120-80-5

22120-80-5 structural image
Product Name: Benzo[b]thiophene-2-carboxylic acid, 3-formyl-
Formula: C10H6O3S
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COMPUTED DESCRIPTORS

Molecular Weight 206.22 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 206.00376522 g/mol
Monoisotopic Mass 206.00376522 g/mol
Topological Polar Surface Area 82.6 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 254
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