320424-38-2
Product Name:
3-(3,5-DIBROMO-1H-1,2,4-TRIAZOL-1-YL)-2-BUTANONE
Formula:
C6H7Br2N3O
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COMPUTED DESCRIPTORS
| Molecular Weight | 296.95 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 296.89354 g/mol |
| Monoisotopic Mass | 294.89559 g/mol |
| Topological Polar Surface Area | 47.8 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 190 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |