579-41-9
Product Name:
1,3-Butanedione, 4,4,4-trifluoro-2-methyl-1-(5-methyl-2-thienyl)-
Formula:
C10H9F3O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 250.24 g/mol |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 3 |
| Exact Mass | 250.02753519 g/mol |
| Monoisotopic Mass | 250.02753519 g/mol |
| Topological Polar Surface Area | 62.4 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 301 |
| 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 |