937604-60-9
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 |