2054953-21-6
Product Name:
3-[3,5-bis(difluoromethyl)-1H-pyrazol-1-yl]-4,4,4-trifluorobutanoic acid
Formula:
C9H7F7N2O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 308.15 g/mol |
|---|---|
| XLogP3 | 2.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 5 |
| Exact Mass | 308.03957460 g/mol |
| Monoisotopic Mass | 308.03957460 g/mol |
| Topological Polar Surface Area | 55.1 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 350 |
| 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 |