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620099-68-5

620099-68-5 structural image
Product Name: 3-(6-NITRO-1-OXO-1,3-DIHYDRO-2H-ISOINDOL-2-YL)PROPANOIC ACID
Formula: C11H10N2O5
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COMPUTED DESCRIPTORS

Molecular Weight 250.21 g/mol
XLogP3 0.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 250.05897142 g/mol
Monoisotopic Mass 250.05897142 g/mol
Topological Polar Surface Area 103 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 378
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