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1092308-69-4

1092308-69-4 structural image
Product Name: Benzoic acid, 3-bromo-5-chloro-4-methoxy-, methyl ester
Formula: C9H8BrClO3
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COMPUTED DESCRIPTORS

Molecular Weight 279.51 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 277.93453 g/mol
Monoisotopic Mass 277.93453 g/mol
Topological Polar Surface Area 35.5 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 212
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