866472-53-9
Product Name:
2-Ethyl-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Formula:
C6H7F3N2O
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COMPUTED DESCRIPTORS
| Molecular Weight | 180.13 g/mol |
|---|---|
| XLogP3 | 1.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 1 |
| Exact Mass | 180.05104734 g/mol |
| Monoisotopic Mass | 180.05104734 g/mol |
| Topological Polar Surface Area | 32.7 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 233 |
| 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 |