HuagongsheHuagongshe Chemistry Print Report · For research reference only
1-(4,5,6,7-Tetrahydro-1H-indol-3-yl)ethanone
1-(4,5,6,7-tetrahydro-1H-indol-3-yl)ethanone · Ethanone, 1-(4,5,6,7-tetrahydro-1H-indol-3-yl)- · Ethanone, 1-(4,5,6,7-tetrahydro-1H-indol-3-yl)- (9CI)
Identifiers & Physical Properties
| CAS No. | 169501-32-0 |
|---|---|
| Molecular formula | C10H13NO |
| Average molar mass | 163.22 g/mol |
| SMILES | CC(=O)c1c[nH]c2c1CCCC2 |
| InChIKey | VMTVBDLGVRDQGZ-UHFFFAOYSA-N |
Chemical & Physical Properties
| XLogP | 1.6 |
|---|---|
| Topological polar surface area | 32.9 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 1 |
| Rotatable bonds | 1 |
| Heavy atoms | 12 |
| Formal charge | 0 |
| Complexity | 190 |