HuagongsheHuagongshe Chemistry Print Report · For research reference only
1,2,4-Triazolidine-3,5-dione, 4-phenyl-1-(2-propenyl)-
Identifiers & Physical Properties
| CAS No. | 73970-92-0 |
|---|---|
| Molecular formula | C11H11N3O2 |
| Average molar mass | 217.22 g/mol |
| Monoisotopic mass | 217.0851266 g/mol |
| SMILES | C=CCn1[nH]c(=O)n(-c2ccccc2)c1=O |
| InChIKey | DTCNBFNYWHARQU-UHFFFAOYSA-N |
| PubChem CID | 10030833 |
| DTXSID | DTXSID60434408 |
Chemical & Physical Properties
| XLogP | 1.5 |
|---|---|
| Topological polar surface area | 52.7 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 3 |
| Heavy atoms | 16 |
| Formal charge | 0 |
| Complexity | 310 |