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117457-10-0

117457-10-0 structural image
Product Name: 2-([CYANO(1,3-DIOXO-1,3-DIHYDRO-2H-INDEN-2-YLIDEN)METHYL]AMINO)ACETIC ACID
Formula: C13H8N2O4
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COMPUTED DESCRIPTORS

Molecular Weight 256.21 g/mol
XLogP3 1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 3
Exact Mass 256.04840674 g/mol
Monoisotopic Mass 256.04840674 g/mol
Topological Polar Surface Area 111 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 538
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