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389084-12-2

389084-12-2 structural image
Product Name: 2-NITRO-1-(2-PYRIDYLTHIO)-4-(TRIFLUOROMETHYL)BENZENE
Formula: C12H7F3N2O2S
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COMPUTED DESCRIPTORS

Molecular Weight 300.26 g/mol
XLogP3 4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 2
Exact Mass 300.01803313 g/mol
Monoisotopic Mass 300.01803313 g/mol
Topological Polar Surface Area 84 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 349
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