2054953-35-2
Product Name:
ethyl 3-(3,5-dimethyl-1H-pyrazol-1-yl)-4,4,4-trifluorobutanoate
Formula:
C11H15F3N2O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 264.24 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 5 |
| Exact Mass | 264.10856221 g/mol |
| Monoisotopic Mass | 264.10856221 g/mol |
| Topological Polar Surface Area | 44.1 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 297 |
| 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 |