HuagongsheHuagongshe Chemistry Print Report · For research reference only
(E)-2-(Phenylmethylidene)deca-3,9-diyn-1-al
Identifiers & Physical Properties
| Molecular formula | C17H16O |
|---|---|
| Average molar mass | 236.31 g/mol |
| SMILES | C#CCCCCC#C/C(C=O)=C\c1ccccc1 |
| InChIKey | CXGFDHGCYIXZOM-SAPNQHFASA-N |
| PubChem CID | 11817217 |
Chemical & Physical Properties
| XLogP | 4.1 |
|---|---|
| Topological polar surface area | 17.1 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 1 |
| Rotatable bonds | 6 |
| Heavy atoms | 18 |
| Formal charge | 0 |
| Complexity | 387 |