2-methylpropyl 3-oxo-1H-1,2,3lambda~5~-benzotriazole-1-carboxylate
Chemical Structure Depiction of
2-methylpropyl 3-oxo-1H-1,2,3lambda~5~-benzotriazole-1-carboxylate
2-methylpropyl 3-oxo-1H-1,2,3lambda~5~-benzotriazole-1-carboxylate
Compound characteristics
| Compound ID: | 8013-2899 |
| Compound Name: | 2-methylpropyl 3-oxo-1H-1,2,3lambda~5~-benzotriazole-1-carboxylate |
| Molecular Weight: | 235.24 |
| Molecular Formula: | C11 H13 N3 O3 |
| Smiles: | CC(C)COC(n1c2ccccc2[n+](n1)[O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.4026 |
| logD: | 2.4026 |
| logSw: | -2.3733 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.877 |
| InChI Key: | IZMPSQXIDZBHNX-UHFFFAOYSA-N |