About 2-(2H-pyran-2-yloxy)ethanol
2-(2H-pyran-2-yloxy)ethanol (PubChem CID 66776924) has the molecular formula C7H10O3
and a molecular weight of 142.15 g/mol. Its IUPAC name is 2-(2H-pyran-2-yloxy)ethanol.
Molecular Properties
| Compound Name | 2-(2H-pyran-2-yloxy)ethanol |
| PubChem CID | 66776924 |
| Molecular Formula | C7H10O3 |
| Molecular Weight | 142.15 g/mol |
| Exact Mass | 142.06 |
| IUPAC Name | 2-(2H-pyran-2-yloxy)ethanol |
| SMILES | OCCOC1C=CC=CO1 |
| InChI | InChI=1S/C7H10O3/c8-4-6-10-7-3-1-2-5-9-7/h1-3,5,7-8H,4,6H2 |
| InChIKey | DVPXWBSJPHWCOL-UHFFFAOYSA-N |
| XLogP | 0.42 |
| TPSA | 38.69 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 | 0.42 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-(2H-pyran-2-yloxy)ethanol?
The IUPAC name of 2-(2H-pyran-2-yloxy)ethanol (CID 66776924) is 2-(2H-pyran-2-yloxy)ethanol.
What is the SMILES notation for 2-(2H-pyran-2-yloxy)ethanol?
The canonical SMILES for 2-(2H-pyran-2-yloxy)ethanol is OCCOC1C=CC=CO1.
What is the InChIKey of 2-(2H-pyran-2-yloxy)ethanol?
The InChIKey is DVPXWBSJPHWCOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10O3/c8-4-6-10-7-3-1-2-5-9-7/h1-3,5,7-8H,4,6H2.
What are the key properties of 2-(2H-pyran-2-yloxy)ethanol?
2-(2H-pyran-2-yloxy)ethanol has a molecular weight of 142.15 g/mol, XLogP of 0.42, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2H-pyran-2-yloxy)ethanol is sourced from PubChem (CID 66776924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).