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2364584-56-3

2364584-56-3 structural image
Product Name: tert-butyl 3-Bromo-4-iodo-5-methylbenzoate
Formula: C12H14BrIO2
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COMPUTED DESCRIPTORS

Molecular Weight 397.05 g/mol
XLogP3 4.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 3
Exact Mass 395.92219 g/mol
Monoisotopic Mass 395.92219 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 262
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