HuagongsheHuagongshe Chemistry Print Report · For research reference only
(4E)-2-methylhexa-1,4-diene
Identifiers & Physical Properties
| CAS No. | 6108-96-9 |
|---|---|
| Molecular formula | C7H12 |
| Average molar mass | 96.17 g/mol |
| Monoisotopic mass | 96.09390038 g/mol |
| SMILES | C=C(C)C/C=C/C |
| InChIKey | XBUBWPOBEDQVOO-SNAWJCMRSA-N |
| PubChem CID | 5367524 |
| DTXSID | DTXSID901015950 |
Chemical & Physical Properties
| XLogP | 3 |
|---|---|
| Topological polar surface area | 0 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 0 |
| Rotatable bonds | 2 |
| Heavy atoms | 7 |
| Formal charge | 0 |
| Complexity | 78 |