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937604-60-9

937604-60-9 structural image
Product Name: 4-BROMO-2-METHYL-1-PHENYL-3-((3-(TRIFLUOROMETHYL)PHENOXY)METHYL)-3-PYRAZOLIN-5-ONE
Formula: C18H14BrF3N2O2
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COMPUTED DESCRIPTORS

Molecular Weight 427.2 g/mol
XLogP3 4.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 426.01907 g/mol
Monoisotopic Mass 426.01907 g/mol
Topological Polar Surface Area 32.8 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 561
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