338959-50-5
Product Name:
ETHYL 1-(3-CYANOPHENYL)-5-(TRIFLUOROMETHYL)-1H-PYRAZOLE-4-CARBOXYLATE
Formula:
C14H10F3N3O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 309.24 g/mol |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 4 |
| Exact Mass | 309.07251106 g/mol |
| Monoisotopic Mass | 309.07251106 g/mol |
| Topological Polar Surface Area | 67.9 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 460 |
| 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 |