894802-88-1
Product Name:
3-OXO-4-(3-TRIFLUOROMETHYL-PHENYL)-BUTYRIC ACID ETHYL ESTER
Formula:
C13H13F3O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 274.23 g/mol |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 6 |
| Exact Mass | 274.08167876 g/mol |
| Monoisotopic Mass | 274.08167876 g/mol |
| Topological Polar Surface Area | 43.4 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 326 |
| 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 |