2-(1H-benzotriazol-1-yl)-1-(4-nitrophenyl)ethan-1-one
Chemical Structure Depiction of
2-(1H-benzotriazol-1-yl)-1-(4-nitrophenyl)ethan-1-one
2-(1H-benzotriazol-1-yl)-1-(4-nitrophenyl)ethan-1-one
Compound characteristics
| Compound ID: | 4463-1127 |
| Compound Name: | 2-(1H-benzotriazol-1-yl)-1-(4-nitrophenyl)ethan-1-one |
| Molecular Weight: | 282.26 |
| Molecular Formula: | C14 H10 N4 O3 |
| Smiles: | C(C(c1ccc(cc1)[N+]([O-])=O)=O)n1c2ccccc2nn1 |
| Stereo: | ACHIRAL |
| logP: | 1.9757 |
| logD: | 1.9757 |
| logSw: | -2.4552 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 72.293 |
| InChI Key: | XJLCWAVWERRVAR-UHFFFAOYSA-N |