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1270353-91-7

1270353-91-7 structural image
Product Name: METHYL 4-(1-AMINO-2,2,2-TRIFLUOROETHYL)BENZOATE
Formula: C10H10F3NO2
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COMPUTED DESCRIPTORS

Molecular Weight 233.19 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 3
Exact Mass 233.06636305 g/mol
Monoisotopic Mass 233.06636305 g/mol
Topological Polar Surface Area 52.3 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 247
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