About [5-[2-(2-methoxyethoxy)ethoxymethyl]furan-2-yl]methanol
[5-[2-(2-methoxyethoxy)ethoxymethyl]furan-2-yl]methanol (PubChem CID 104564733) has the molecular formula C11H18O5
and a molecular weight of 230.26 g/mol. Its IUPAC name is [5-[2-(2-methoxyethoxy)ethoxymethyl]furan-2-yl]methanol.
Molecular Properties
| Compound Name | [5-[2-(2-methoxyethoxy)ethoxymethyl]furan-2-yl]methanol |
| PubChem CID | 104564733 |
| Molecular Formula | C11H18O5 |
| Molecular Weight | 230.26 g/mol |
| Exact Mass | 230.12 |
| IUPAC Name | [5-[2-(2-methoxyethoxy)ethoxymethyl]furan-2-yl]methanol |
| SMILES | COCCOCCOCc1ccc(CO)o1 |
| InChI | InChI=1S/C11H18O5/c1-13-4-5-14-6-7-15-9-11-3-2-10(8-12)16-11/h2-3,12H,4-9H2,1H3 |
| InChIKey | ZRYKHDOAEKRWPX-UHFFFAOYSA-N |
| XLogP | 0.95 |
| TPSA | 61.06 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 230.26 |
| LogP ≤ 5 | 0.95 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of [5-[2-(2-methoxyethoxy)ethoxymethyl]furan-2-yl]methanol?
The IUPAC name of [5-[2-(2-methoxyethoxy)ethoxymethyl]furan-2-yl]methanol (CID 104564733) is [5-[2-(2-methoxyethoxy)ethoxymethyl]furan-2-yl]methanol.
What is the SMILES notation for [5-[2-(2-methoxyethoxy)ethoxymethyl]furan-2-yl]methanol?
The canonical SMILES for [5-[2-(2-methoxyethoxy)ethoxymethyl]furan-2-yl]methanol is COCCOCCOCc1ccc(CO)o1.
What is the InChIKey of [5-[2-(2-methoxyethoxy)ethoxymethyl]furan-2-yl]methanol?
The InChIKey is ZRYKHDOAEKRWPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18O5/c1-13-4-5-14-6-7-15-9-11-3-2-10(8-12)16-11/h2-3,12H,4-9H2,1H3.
What are the key properties of [5-[2-(2-methoxyethoxy)ethoxymethyl]furan-2-yl]methanol?
[5-[2-(2-methoxyethoxy)ethoxymethyl]furan-2-yl]methanol has a molecular weight of 230.26 g/mol, XLogP of 0.95, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[2-(2-methoxyethoxy)ethoxymethyl]furan-2-yl]methanol is sourced from PubChem (CID 104564733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).