618-72-4
Product Name:
1-Butanol, 4,4,4-trifluoro-, 1-(3,5-dinitrobenzoate)
Formula:
C11H9F3N2O6
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 322.19 g/mol |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 5 |
| Exact Mass | 322.04127050 g/mol |
| Monoisotopic Mass | 322.04127050 g/mol |
| Topological Polar Surface Area | 118 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 409 |
| 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 |