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838384-24-0

838384-24-0 structural image
Product Name: 6-(benzo[d][1,3]dioxol-5-yl)-1,3-dimethyl-4-oxo-4H-cyclohepta[c]furan-8-yl benzoate
Formula: C25H18O6
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COMPUTED DESCRIPTORS

Molecular Weight 414.4 g/mol
XLogP3 4.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 414.11033829 g/mol
Monoisotopic Mass 414.11033829 g/mol
Topological Polar Surface Area 75 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 779
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