875156-74-4
Product Name:
[3,5-DIMETHYL-1-[3-(TRIFLUOROMETHYL)PHENYL]-1H-PYRAZOL-4-YL](OXO)ACETIC ACID
Formula:
C14H11F3N2O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 312.24 g/mol |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 3 |
| Exact Mass | 312.07217670 g/mol |
| Monoisotopic Mass | 312.07217670 g/mol |
| Topological Polar Surface Area | 72.2 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 455 |
| 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 |