HuagongsheHuagongshe Chemistry Print Report · For research reference only
(E)-5-phenylpent-2-enoic acid
Identifiers & Physical Properties
| Molecular formula | C11H12O2 |
|---|---|
| Average molar mass | 176.21 g/mol |
| Monoisotopic mass | 176.08372962 g/mol |
| SMILES | O=C(O)/C=C/CCc1ccccc1 |
| InChIKey | IATNQCGERGDVDN-WEVVVXLNSA-N |
| PubChem CID | 5367576 |
Chemical & Physical Properties
| XLogP | 2.5 |
|---|---|
| Topological polar surface area | 37.3 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 4 |
| Heavy atoms | 13 |
| Formal charge | 0 |
| Complexity | 179 |