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887976-73-0

887976-73-0 structural image
Product Name: 6-(Benzo[d][1,3]dioxol-5-yl)nicotinic acid
Formula: C13H9NO4
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COMPUTED DESCRIPTORS

Molecular Weight 243.21 g/mol
XLogP3 1.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 243.05315777 g/mol
Monoisotopic Mass 243.05315777 g/mol
Topological Polar Surface Area 68.6 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 322
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