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457097-93-7

457097-93-7 structural image
Product Name: Methyl 4-amino-3-(trifluoromethoxy)benzoate
Formula: C9H8F3NO3
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COMPUTED DESCRIPTORS

Molecular Weight 235.16 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 3
Exact Mass 235.04562760 g/mol
Monoisotopic Mass 235.04562760 g/mol
Topological Polar Surface Area 61.6 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 257
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