4803-08-1
Product Name:
1,2,4-Triazine-3,5(2H,4H)-dione, 6-(trifluoromethyl)-
Formula:
C4H2F3N3O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 181.07 g/mol |
|---|---|
| XLogP3 | 0.9 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 0 |
| Exact Mass | 181.00991080 g/mol |
| Monoisotopic Mass | 181.00991080 g/mol |
| Topological Polar Surface Area | 70.6 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 269 |
| 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 |