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87331-47-3

87331-47-3 structural image
Product Name: 3OUMARIN 525, DYE CONTENT 99
Formula: C22H18N2O3
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COMPUTED DESCRIPTORS

Molecular Weight 358.4 g/mol
XLogP3 4.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 1
Exact Mass 358.13174244 g/mol
Monoisotopic Mass 358.13174244 g/mol
Topological Polar Surface Area 55.6 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 650
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