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13209-77-3

13209-77-3 structural image
Product Name: ETHYL 7-ACETOXYCOUMARIN-3-CARBOXYLATE
Formula: C14H12O6
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COMPUTED DESCRIPTORS

Molecular Weight 276.24 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 5
Exact Mass 276.06338810 g/mol
Monoisotopic Mass 276.06338810 g/mol
Topological Polar Surface Area 78.9 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 453
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