About 1-(furan-2-ylmethoxy)ethanol
1-(furan-2-ylmethoxy)ethanol (PubChem CID 20517704) has the molecular formula C7H10O3
and a molecular weight of 142.15 g/mol. Its IUPAC name is 1-(furan-2-ylmethoxy)ethanol.
Molecular Properties
| Compound Name | 1-(furan-2-ylmethoxy)ethanol |
| PubChem CID | 20517704 |
| Molecular Formula | C7H10O3 |
| Molecular Weight | 142.15 g/mol |
| Exact Mass | 142.06 |
| IUPAC Name | 1-(furan-2-ylmethoxy)ethanol |
| SMILES | CC(O)OCc1ccco1 |
| InChI | InChI=1S/C7H10O3/c1-6(8)10-5-7-3-2-4-9-7/h2-4,6,8H,5H2,1H3 |
| InChIKey | IFZCZLZLIUNYLA-UHFFFAOYSA-N |
| XLogP | 1.13 |
| TPSA | 42.60 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 10 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 142.15 |
| LogP ≤ 5 | 1.13 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 1-(furan-2-ylmethoxy)ethanol?
The IUPAC name of 1-(furan-2-ylmethoxy)ethanol (CID 20517704) is 1-(furan-2-ylmethoxy)ethanol.
What is the SMILES notation for 1-(furan-2-ylmethoxy)ethanol?
The canonical SMILES for 1-(furan-2-ylmethoxy)ethanol is CC(O)OCc1ccco1.
What is the InChIKey of 1-(furan-2-ylmethoxy)ethanol?
The InChIKey is IFZCZLZLIUNYLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10O3/c1-6(8)10-5-7-3-2-4-9-7/h2-4,6,8H,5H2,1H3.
What are the key properties of 1-(furan-2-ylmethoxy)ethanol?
1-(furan-2-ylmethoxy)ethanol has a molecular weight of 142.15 g/mol, XLogP of 1.13, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-ylmethoxy)ethanol is sourced from PubChem (CID 20517704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).