(1H-benzotriazol-1-yl)(4-methyl-3-nitrophenyl)methanone
Chemical Structure Depiction of
(1H-benzotriazol-1-yl)(4-methyl-3-nitrophenyl)methanone
(1H-benzotriazol-1-yl)(4-methyl-3-nitrophenyl)methanone
Compound characteristics
| Compound ID: | 1778-0579 |
| Compound Name: | (1H-benzotriazol-1-yl)(4-methyl-3-nitrophenyl)methanone |
| Molecular Weight: | 282.26 |
| Molecular Formula: | C14 H10 N4 O3 |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)C(n1c2ccccc2nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3871 |
| logD: | 2.3871 |
| logSw: | -2.567 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 72.077 |
| InChI Key: | XWKFGJPXWSWHDR-UHFFFAOYSA-N |