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94978-86-6

94978-86-6 structural image
Product Name: 3-CYANO-6,7-DIMETHYLCHROMONE
Formula: C12H9NO2
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COMPUTED DESCRIPTORS

Molecular Weight 199.20 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 0
Exact Mass 199.063328530 g/mol
Monoisotopic Mass 199.063328530 g/mol
Topological Polar Surface Area 50.1 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 363
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