2-(1H-benzotriazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one
Chemical Structure Depiction of
2-(1H-benzotriazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one
2-(1H-benzotriazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one
Compound characteristics
| Compound ID: | 8015-2235 |
| Compound Name: | 2-(1H-benzotriazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one |
| Molecular Weight: | 245.23 |
| Molecular Formula: | C12 H11 N3 O3 |
| Smiles: | C1C(C2COC(C1=O)O2)n1c2ccccc2nn1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.47 |
| logD: | 0.47 |
| logSw: | -1.3132 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.958 |
| InChI Key: | UTXWASRJXOSPDO-UHFFFAOYSA-N |