2054953-10-3
Product Name:
ethyl 3-[3-(difluoromethyl)-1H-pyrazol-1-yl]-4,4,4-trifluorobutanoate
Formula:
C10H11F5N2O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 286.20 g/mol |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 6 |
| Exact Mass | 286.07406841 g/mol |
| Monoisotopic Mass | 286.07406841 g/mol |
| Topological Polar Surface Area | 44.1 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 311 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |