76344-91-7
Product Name:
ethyl 5-(2-(trifluoromethyl)phenyl)isoxazole-4-carboxylate
Formula:
C13H10F3NO3
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COMPUTED DESCRIPTORS
| Molecular Weight | 285.22 g/mol |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 4 |
| Exact Mass | 285.06127767 g/mol |
| Monoisotopic Mass | 285.06127767 g/mol |
| Topological Polar Surface Area | 52.3 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 348 |
| 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 |