2,2,4-trimethyl-1,2-dihydroquinolin-6-yl (2-nitrophenoxy)acetate
Chemical Structure Depiction of
2,2,4-trimethyl-1,2-dihydroquinolin-6-yl (2-nitrophenoxy)acetate
2,2,4-trimethyl-1,2-dihydroquinolin-6-yl (2-nitrophenoxy)acetate
Compound characteristics
| Compound ID: | 3390-0162 |
| Compound Name: | 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl (2-nitrophenoxy)acetate |
| Molecular Weight: | 368.39 |
| Molecular Formula: | C20 H20 N2 O5 |
| Smiles: | CC1=CC(C)(C)Nc2ccc(cc12)OC(COc1ccccc1[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.978 |
| logD: | 3.9779 |
| logSw: | -4.2374 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.886 |
| InChI Key: | YCEJBAUTEBOUMK-UHFFFAOYSA-N |