149771-12-0
Product Name:
ethyl 2-(methylsulfanyl)-4-(trifluoromethyl)pyrimidine-5-carboxylate
Formula:
C9H9F3N2O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 266.24 g/mol |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 4 |
| Exact Mass | 266.03368319 g/mol |
| Monoisotopic Mass | 266.03368319 g/mol |
| Topological Polar Surface Area | 77.4 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 276 |
| 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 |