89488-98-2
Product Name:
isopropyl 3-amino-1H-1,2,4-triazole-5-carboxylate
Formula:
C6H10N4O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 170.17 g/mol |
|---|---|
| XLogP3 | 0.6 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 170.08037557 g/mol |
| Monoisotopic Mass | 170.08037557 g/mol |
| Topological Polar Surface Area | 93.9 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 173 |
| 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 |