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948551-74-4

948551-74-4 structural image
Product Name: 5-ISOCYANATO-2-TRIFLUOROMETHYL-PYRIDINE
Formula: C7H3F3N2O
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COMPUTED DESCRIPTORS

Molecular Weight 188.11 g/mol
XLogP3 2.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 1
Exact Mass 188.01974721 g/mol
Monoisotopic Mass 188.01974721 g/mol
Topological Polar Surface Area 42.3 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 222
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