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861905-85-3

861905-85-3 structural image
Product Name: tert-butyl 3-fluoro-5-iodo-4-methylbenzoate
Formula: C12H14FIO2
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COMPUTED DESCRIPTORS

Molecular Weight 336.14 g/mol
XLogP3 3.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 336.00226 g/mol
Monoisotopic Mass 336.00226 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