2126161-99-5
Product Name:
lithium 4-(5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)benzoate
Formula:
C9H6LiN3O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 211.1 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 211.05691950 g/mol |
| Monoisotopic Mass | 211.05691950 g/mol |
| Topological Polar Surface Area | 93.6 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 324 |
| 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 | 2 |
| Compound Is Canonicalized | Yes |