2-ethyl-7-oxoazepane-2-carboxylic acid
Chemical Structure Depiction of
2-ethyl-7-oxoazepane-2-carboxylic acid
2-ethyl-7-oxoazepane-2-carboxylic acid
Compound characteristics
| Compound ID: | S515-0417 |
| Compound Name: | 2-ethyl-7-oxoazepane-2-carboxylic acid |
| Molecular Weight: | 185.22 |
| Molecular Formula: | C9 H15 N O3 |
| Smiles: | CCC1(CCCCC(N1)=O)C(O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.2664 |
| logD: | -3.0832 |
| logSw: | -0.8589 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.021 |
| InChI Key: | HIHUETAKUYLJFA-VIFPVBQESA-N |