HuagongsheHuagongshe Chemistry Print Report · For research reference only
1-(5-hydroxy-2-methyl-1H-indol-3-yl)ethanone
AKOS BC-1854 · IFLAB-BB F0913-0483 · 1-(5-HYDROXY-2-METHYL-1H-INDOL-3-YL)-ETHANONE · Ethanone, 1-(5-hydroxy-2-methyl-1H-indol-3-yl)- · 1-(5-hydroxy-2-methyl-1H-indol-3-yl)ethan-1-one
Identifiers & Physical Properties
| CAS No. | 57827-05-1 |
|---|---|
| Molecular formula | C11H11NO2 |
| Average molar mass | 189.21 g/mol |
| Monoisotopic mass | 189.07897859 g/mol |
| SMILES | CC(=O)c1c(C)[nH]c2ccc(O)cc12 |
| InChIKey | VUJJJKGOIKLXIZ-UHFFFAOYSA-N |
| PubChem CID | 763539 |
| DTXSID | DTXSID40354099 |
Chemical & Physical Properties
| XLogP | 1.8 |
|---|---|
| Topological polar surface area | 53.1 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 1 |
| Heavy atoms | 14 |
| Formal charge | 0 |
| Complexity | 241 |