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89446-98-0

89446-98-0 structural image
Product Name: 3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)benzoic acid
Formula: C15H13NO4
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COMPUTED DESCRIPTORS

Molecular Weight 271.27 g/mol
XLogP3 1.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 271.08445790 g/mol
Monoisotopic Mass 271.08445790 g/mol
Topological Polar Surface Area 74.7 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 458
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes