HuagongsheHuagongshe Chemistry Print Report · For research reference only
Methanediol, methoxy-
Identifiers & Physical Properties
| CAS No. | 34405-39-5 |
|---|---|
| Molecular formula | C2H6O3 |
| Average molar mass | 78.07 g/mol |
| Monoisotopic mass | 78.03169405 g/mol |
| SMILES | COC(O)O |
| InChIKey | YENFRIPPRDTIBH-UHFFFAOYSA-N |
| PubChem CID | 5231663 |
| DTXSID | DTXSID30411842 |
Chemical & Physical Properties
| XLogP | -1 |
|---|---|
| Topological polar surface area | 49.7 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 1 |
| Heavy atoms | 5 |
| Formal charge | 0 |
| Complexity | 18.9 |