4-(adamantan-1-yl)phenyl 4-(adamantan-2-yl)phenyl (adamantan-1-yl)propanedioate
Chemical Structure Depiction of
4-(adamantan-1-yl)phenyl 4-(adamantan-2-yl)phenyl (adamantan-1-yl)propanedioate
4-(adamantan-1-yl)phenyl 4-(adamantan-2-yl)phenyl (adamantan-1-yl)propanedioate
Compound characteristics
| Compound ID: | 1493-0467 |
| Compound Name: | 4-(adamantan-1-yl)phenyl 4-(adamantan-2-yl)phenyl (adamantan-1-yl)propanedioate |
| Molecular Weight: | 658.92 |
| Molecular Formula: | C45 H54 O4 |
| Smiles: | C1C2CC3CC1CC(C2)C3c1ccc(cc1)OC(C(C(=O)Oc1ccc(cc1)C12CC3CC(CC(C3)C2)C1)C12CC3CC(CC(C3)C2)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 11.8371 |
| logD: | 11.8371 |
| logSw: | -6.3923 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.551 |
| InChI Key: | ILTGJVXVYDIUCA-FCCAGTRESA-N |