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1805032-54-5

1805032-54-5 structural image
Product Name: Benzeneacetic acid, 3,4,5-trifluoro-α-hydroxy-2-methoxy-
Formula: C9H7F3O4
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COMPUTED DESCRIPTORS

Molecular Weight 236.14 g/mol
XLogP3 1.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 3
Exact Mass 236.02964319 g/mol
Monoisotopic Mass 236.02964319 g/mol
Topological Polar Surface Area 66.8 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 263
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes