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933585-68-3

933585-68-3 structural image
Product Name: Benzoic acid, 5-chloro-2,3-diiodo-, methyl ester
Formula: C8H5ClI2O2
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COMPUTED DESCRIPTORS

Molecular Weight 422.38 g/mol
XLogP3 3.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 421.80675 g/mol
Monoisotopic Mass 421.80675 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 201
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