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1024209-91-3

1024209-91-3 structural image
Product Name: 2-AMINO-4-BENZO[D]1,3-DIOXOLEN-5-YL-7-METHYL-5-OXO-4,6,7,8-TETRAHYDRO2H-CHROMENE-3-CARBONITRILE
Formula: C18H16N2O4
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COMPUTED DESCRIPTORS

Molecular Weight 324.3 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 1
Exact Mass 324.11100700 g/mol
Monoisotopic Mass 324.11100700 g/mol
Topological Polar Surface Area 94.6 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 686
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