231301-31-8
Product Name:
1-ACETYL-4-CHLORO-3(5)-[1-(HEPTAFLUOROPROP-1-OXY)TETRAFLUOROETHYL]-5(3)-(METHYL)PYRAZOLE
Formula:
C11H6ClF11N2O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 442.61 g/mol |
|---|---|
| XLogP3 | 4.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 14 |
| Rotatable Bond Count | 4 |
| Exact Mass | 441.9942149 g/mol |
| Monoisotopic Mass | 441.9942149 g/mol |
| Topological Polar Surface Area | 44.1 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 582 |
| 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 |