(adamantan-1-yl)methyl 3,5-dinitrobenzoate
Chemical Structure Depiction of
(adamantan-1-yl)methyl 3,5-dinitrobenzoate
(adamantan-1-yl)methyl 3,5-dinitrobenzoate
Compound characteristics
| Compound ID: | 0508-1848 |
| Compound Name: | (adamantan-1-yl)methyl 3,5-dinitrobenzoate |
| Molecular Weight: | 360.36 |
| Molecular Formula: | C18 H20 N2 O6 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)COC(c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0931 |
| logD: | 5.0931 |
| logSw: | -5.2651 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 87.893 |
| InChI Key: | SGDSIRSJYXTFJF-UHFFFAOYSA-N |