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31083-13-3

31083-13-3 structural image
Product Name: ETHYL 2-(TRIFLUOROMETHYL)BENZOATE
Formula: C10H9F3O2
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COMPUTED DESCRIPTORS

Molecular Weight 218.17 g/mol
XLogP3 2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 218.05546401 g/mol
Monoisotopic Mass 218.05546401 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 225
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