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854658-72-3

854658-72-3 structural image
Product Name: ETHYL 6-(4-IODOPHENYL)-6-OXOHEXANOATE
Formula: C14H17IO3
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COMPUTED DESCRIPTORS

Molecular Weight 360.19 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 8
Exact Mass 360.02224 g/mol
Monoisotopic Mass 360.02224 g/mol
Topological Polar Surface Area 43.4 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 270
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