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866238-73-5

866238-73-5 structural image
Product Name: methyl 4-(2,7-dimethyl-3,9-dioxo-1,2,3,9-tetrahydrochromeno[2,3-c]pyrrol-1-yl)benzoate
Formula: C21H17NO5
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COMPUTED DESCRIPTORS

Molecular Weight 363.4 g/mol
XLogP3 2.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 363.11067264 g/mol
Monoisotopic Mass 363.11067264 g/mol
Topological Polar Surface Area 72.9 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 691
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes