2-chloro-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-carboxylic acid
Chemical Structure Depiction of
2-chloro-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-carboxylic acid
2-chloro-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-carboxylic acid
Compound characteristics
| Compound ID: | 3752-0052 |
| Compound Name: | 2-chloro-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-carboxylic acid |
| Molecular Weight: | 241.67 |
| Molecular Formula: | C11 H12 Cl N O3 |
| Smiles: | CC1(C)Cc2c(CO1)cc(C(O)=O)c(n2)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.398 |
| logD: | -0.4828 |
| logSw: | -2.79 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.018 |
| InChI Key: | HXKKGIJJSWDNKE-UHFFFAOYSA-N |