449778-73-8
Product Name:
1-METHYL-5-(4-METHYLPHENOXY)-3-(TRIFLUOROMETHYL)-1H-PYRAZOLE-4-CARBALDEHYDE
Formula:
C13H11F3N2O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 284.23 g/mol |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 3 |
| Exact Mass | 284.07726208 g/mol |
| Monoisotopic Mass | 284.07726208 g/mol |
| Topological Polar Surface Area | 44.1 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 343 |
| 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 |