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1261861-80-6

1261861-80-6 structural image
Product Name: 2-amino-6-(trifluoromethoxy)benzonitrile
Formula: C8H5F3N2O
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COMPUTED DESCRIPTORS

Molecular Weight 202.13 g/mol
XLogP3 2.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 1
Exact Mass 202.03539727 g/mol
Monoisotopic Mass 202.03539727 g/mol
Topological Polar Surface Area 59 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 245
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