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331821-13-7

331821-13-7 structural image
Product Name: 2H-1-Benzopyran-2-one, 6-bromo-8-chloro-3-(4-hydroxyphenyl)-4-methyl-
Formula: C16H10BrClO3
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COMPUTED DESCRIPTORS

Molecular Weight 365.60 g/mol
XLogP3 4.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 363.95018 g/mol
Monoisotopic Mass 363.95018 g/mol
Topological Polar Surface Area 46.5 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 456
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