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91454-65-8

91454-65-8 structural image
Product Name: 7-[(CHLOROCARBONYL)METHOXY]-4-METHYLCOUMARIN
Formula: C12H9ClO4
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COMPUTED DESCRIPTORS

Molecular Weight 252.65 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 252.0189365 g/mol
Monoisotopic Mass 252.0189365 g/mol
Topological Polar Surface Area 52.6 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 364
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