(1H-benzotriazol-1-yl)(3-nitrophenyl)methanone
Chemical Structure Depiction of
(1H-benzotriazol-1-yl)(3-nitrophenyl)methanone
(1H-benzotriazol-1-yl)(3-nitrophenyl)methanone
Compound characteristics
| Compound ID: | 8004-0405 |
| Compound Name: | (1H-benzotriazol-1-yl)(3-nitrophenyl)methanone |
| Molecular Weight: | 268.23 |
| Molecular Formula: | C13 H8 N4 O3 |
| Smiles: | c1ccc2c(c1)nnn2C(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9848 |
| logD: | 1.9848 |
| logSw: | -2.2506 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 72.378 |
| InChI Key: | MXXZHDYGAKNXLA-UHFFFAOYSA-N |