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694499-69-9

694499-69-9 structural image
Product Name: (6-NITRO-1-OXO-1,3-DIHYDRO-2H-ISOINDOL-2-YL)ACETIC ACID
Formula: C10H8N2O5
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COMPUTED DESCRIPTORS

Molecular Weight 236.18 g/mol
XLogP3 0.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 236.04332136 g/mol
Monoisotopic Mass 236.04332136 g/mol
Topological Polar Surface Area 103 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 364
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