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436100-82-2

436100-82-2 structural image
Product Name: N-[2-(1,3-DIMETHYL-4-NITRO-1H-PYRAZOL-5-YL)VINYL]-4-(TRIFLUOROMETHOXY)ANILINE
Formula: C14H13F3N4O3
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COMPUTED DESCRIPTORS

Molecular Weight 342.27 g/mol
XLogP3 3.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 4
Exact Mass 342.09397478 g/mol
Monoisotopic Mass 342.09397478 g/mol
Topological Polar Surface Area 84.9 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 461
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes