3-(2-bromoethyl)adamantane-1-carboxylic acid
Chemical Structure Depiction of
3-(2-bromoethyl)adamantane-1-carboxylic acid
3-(2-bromoethyl)adamantane-1-carboxylic acid
Compound characteristics
| Compound ID: | 1493-0065 |
| Compound Name: | 3-(2-bromoethyl)adamantane-1-carboxylic acid |
| Molecular Weight: | 287.19 |
| Molecular Formula: | C13 H19 Br O2 |
| Smiles: | C1C2CC3(CC[Br])CC1CC(C2)(C3)C(O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.6332 |
| logD: | 1.3402 |
| logSw: | -3.7296 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.6799 |
| InChI Key: | ZRVHQPVFIIJIAI-UHFFFAOYSA-N |