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343373-30-8

343373-30-8 structural image
Product Name: 2-[2,6-DINITRO-4-(TRIFLUOROMETHYL)PHENYL]-4-(4-ISOPROPYLPHENYL)-2,4-DIHYDRO-3H-1,2,4-TRIAZOL-3-ONE
Formula: C18H14F3N5O5
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COMPUTED DESCRIPTORS

Molecular Weight 437.3 g/mol
XLogP3 4.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 3
Exact Mass 437.09470305 g/mol
Monoisotopic Mass 437.09470305 g/mol
Topological Polar Surface Area 128 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 718
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