231301-09-0
Product Name:
1-ACETYL-3(5)-(NONAFLUORO-1-BUTYL)-5(3)-(TRIFLUOROMETHYL)PYRAZOLE
Formula:
C10H4F12N2O
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 396.13 g/mol |
|---|---|
| XLogP3 | 4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 14 |
| Rotatable Bond Count | 3 |
| Exact Mass | 396.0132007 g/mol |
| Monoisotopic Mass | 396.0132007 g/mol |
| Topological Polar Surface Area | 34.9 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 525 |
| 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 |