305353-87-1
Product Name:
5-(diethylazaniumyl)-2-[(E)-1,2,4-triazol-4-yliminomethyl]phenolate
Formula:
C13H17N5O
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COMPUTED DESCRIPTORS
| Molecular Weight | 259.31 g/mol |
|---|---|
| XLogP3 | 1.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 259.14331018 g/mol |
| Monoisotopic Mass | 259.14331018 g/mol |
| Topological Polar Surface Area | 66.5 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 289 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |