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331821-06-8

331821-06-8 structural image
Product Name: 8-BROMO-6-CHLORO-3-CYANO-4-METHYLCOUMARIN
Formula: C11H5BrClNO2
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COMPUTED DESCRIPTORS

Molecular Weight 298.52 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 0
Exact Mass 296.91922 g/mol
Monoisotopic Mass 296.91922 g/mol
Topological Polar Surface Area 50.1 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 412
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

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