2-methyl-4,6-diphenylpyran-1-ium--carboxymethanesulfonate (1/1)
Chemical Structure Depiction of
2-methyl-4,6-diphenylpyran-1-ium--carboxymethanesulfonate (1/1)
2-methyl-4,6-diphenylpyran-1-ium--carboxymethanesulfonate (1/1)
Compound characteristics
| Compound ID: | 3331-3680 |
| Compound Name: | 2-methyl-4,6-diphenylpyran-1-ium--carboxymethanesulfonate (1/1) |
| Molecular Weight: | 386.42 |
| Molecular Formula: | C18 H15 O |
| Salt: | HOOCCH2SO3- |
| Smiles: | CC1=CC(=CC(c2ccccc2)=[O+]1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.3767 |
| logD: | 4.3767 |
| logSw: | -4.4246 |
| Hydrogen bond acceptors count: | 1 |
| Polar surface area: | 6.6654 |
| InChI Key: | DLYSUUIMSFGXDL-UHFFFAOYSA-N |