HuagongsheHuagongshe Chemistry Print Report · For research reference only
1-Ethenoxy-6-methylheptane;prop-2-enoic acid
Identifiers & Physical Properties
| CAS No. | 66983-02-6 |
|---|---|
| Molecular formula | C13H24O3 |
| Average molar mass | 228.33 g/mol |
| Monoisotopic mass | 228.17254462 g/mol |
| SMILES | C=CC(=O)O.C=COCCCCCC(C)C |
| InChIKey | UINWZLARGLZXMI-UHFFFAOYSA-N |
| PubChem CID | 3050737 |
| DTXSID | DTXSID30217189 |
Chemical & Physical Properties
| Topological polar surface area | 46.5 |
|---|---|
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 8 |
| Heavy atoms | 16 |
| Formal charge | 0 |
| Complexity | 143 |