3-nitrophenyl 4-(adamantan-1-yl)benzoate
Chemical Structure Depiction of
3-nitrophenyl 4-(adamantan-1-yl)benzoate
3-nitrophenyl 4-(adamantan-1-yl)benzoate
Compound characteristics
| Compound ID: | 1493-0519 |
| Compound Name: | 3-nitrophenyl 4-(adamantan-1-yl)benzoate |
| Molecular Weight: | 377.44 |
| Molecular Formula: | C23 H23 N O4 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)c1ccc(cc1)C(=O)Oc1cccc(c1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 6.4438 |
| logD: | 6.4438 |
| logSw: | -6.2228 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.759 |
| InChI Key: | YWLIXKBVLOGVQI-UHFFFAOYSA-N |