About ethane-1,2-diol;ethene;ethoxyethane
ethane-1,2-diol;ethene;ethoxyethane (PubChem CID 173009607) has the molecular formula C10H24O3
and a molecular weight of 192.30 g/mol. Its IUPAC name is ethane-1,2-diol;ethene;ethoxyethane.
Molecular Properties
| Compound Name | ethane-1,2-diol;ethene;ethoxyethane |
| PubChem CID | 173009607 |
| Molecular Formula | C10H24O3 |
| Molecular Weight | 192.30 g/mol |
| Exact Mass | 192.17 |
| IUPAC Name | ethane-1,2-diol;ethene;ethoxyethane |
| SMILES | C=C.C=C.CCOCC.OCCO |
| InChI | InChI=1S/C4H10O.C2H6O2.2C2H4/c1-3-5-4-2;3-1-2-4;2*1-2/h3-4H2,1-2H3;3-4H,1-2H2;2*1-2H2 |
| InChIKey | ZTLATWRFZBYBMA-UHFFFAOYSA-N |
| XLogP | 1.62 |
| TPSA | 49.69 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 192.30 |
| LogP ≤ 5 | 1.62 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of ethane-1,2-diol;ethene;ethoxyethane?
The IUPAC name of ethane-1,2-diol;ethene;ethoxyethane (CID 173009607) is ethane-1,2-diol;ethene;ethoxyethane.
What is the SMILES notation for ethane-1,2-diol;ethene;ethoxyethane?
The canonical SMILES for ethane-1,2-diol;ethene;ethoxyethane is C=C.C=C.CCOCC.OCCO.
What is the InChIKey of ethane-1,2-diol;ethene;ethoxyethane?
The InChIKey is ZTLATWRFZBYBMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O.C2H6O2.2C2H4/c1-3-5-4-2;3-1-2-4;2*1-2/h3-4H2,1-2H3;3-4H,1-2H2;2*1-2H2.
What are the key properties of ethane-1,2-diol;ethene;ethoxyethane?
ethane-1,2-diol;ethene;ethoxyethane has a molecular weight of 192.30 g/mol, XLogP of 1.62, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane-1,2-diol;ethene;ethoxyethane is sourced from PubChem (CID 173009607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).