propan-2-yl 4-(1H-benzotriazol-1-yl)-4-oxobutanoate
Chemical Structure Depiction of
propan-2-yl 4-(1H-benzotriazol-1-yl)-4-oxobutanoate
propan-2-yl 4-(1H-benzotriazol-1-yl)-4-oxobutanoate
Compound characteristics
| Compound ID: | 8008-9452 |
| Compound Name: | propan-2-yl 4-(1H-benzotriazol-1-yl)-4-oxobutanoate |
| Molecular Weight: | 261.28 |
| Molecular Formula: | C13 H15 N3 O3 |
| Smiles: | CC(C)OC(CCC(n1c2ccccc2nn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.338 |
| logD: | 1.338 |
| logSw: | -1.7246 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.578 |
| InChI Key: | JLRISBWJULUSCP-UHFFFAOYSA-N |