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566198-35-4

566198-35-4 structural image
Product Name: 6-(3-Formylphenyl)-nicotinic acid
Formula: C13H9NO3
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COMPUTED DESCRIPTORS

Molecular Weight 227.21 g/mol
XLogP3 1.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 227.058243149 g/mol
Monoisotopic Mass 227.058243149 g/mol
Topological Polar Surface Area 67.3 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 292
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