2-(diethylamino)-7-hydroxy-1-benzopyran-1-ium--perchlorate (1/1)
Chemical Structure Depiction of
2-(diethylamino)-7-hydroxy-1-benzopyran-1-ium--perchlorate (1/1)
2-(diethylamino)-7-hydroxy-1-benzopyran-1-ium--perchlorate (1/1)
Compound characteristics
| Compound ID: | 0099-0271 |
| Compound Name: | 2-(diethylamino)-7-hydroxy-1-benzopyran-1-ium--perchlorate (1/1) |
| Molecular Weight: | 317.72 |
| Molecular Formula: | C13 H16 N O2 |
| Salt: | ClO4- |
| Smiles: | CCN(CC)C1C=Cc2ccc(cc2[O+]=1)O |
| Stereo: | ACHIRAL |
| logP: | 2.3022 |
| logD: | 2.1804 |
| logSw: | -2.1521 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 26.5261 |
| InChI Key: | CQKYOCOILFAZID-UHFFFAOYSA-O |