HuagongsheHuagongshe Chemistry Print Report · For research reference only
3-benzoyl-1-ethyl-9H-carbazole-2-carboxylic acid
Identifiers & Physical Properties
| CAS No. | 91545-00-5 |
|---|---|
| Molecular formula | C22H17NO3 |
| Average molar mass | 343.4 g/mol |
| Monoisotopic mass | 343.1208434 g/mol |
| SMILES | CCc1c(C(=O)O)c(C(=O)c2ccccc2)cc2c1[nH]c1ccccc12 |
| InChIKey | PAZXOEPSVKYSHX-UHFFFAOYSA-N |
| PubChem CID | 335708 |
| DTXSID | DTXSID10319514 |
Chemical & Physical Properties
| XLogP | 5.1 |
|---|---|
| Topological polar surface area | 70.2 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 4 |
| Heavy atoms | 26 |
| Formal charge | 0 |
| Complexity | 542 |