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138984-58-4

138984-58-4 structural image
Product Name: 2-METHYL-4-PHENYL-5-(TRIFLUOROMETHYL)-2,4-DIHYDRO-3H-1,2,4-TRIAZOLE-3-THIONE
Formula: C10H8F3N3S
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COMPUTED DESCRIPTORS

Molecular Weight 259.25 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 1
Exact Mass 259.03910293 g/mol
Monoisotopic Mass 259.03910293 g/mol
Topological Polar Surface Area 50.9 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 347
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