About 2-(1-methoxyethoxy)ethylcyclohexane
2-(1-methoxyethoxy)ethylcyclohexane (PubChem CID 21363344) has the molecular formula C11H22O2
and a molecular weight of 186.29 g/mol. Its IUPAC name is 2-(1-methoxyethoxy)ethylcyclohexane.
Molecular Properties
| Compound Name | 2-(1-methoxyethoxy)ethylcyclohexane |
| PubChem CID | 21363344 |
| Molecular Formula | C11H22O2 |
| Molecular Weight | 186.29 g/mol |
| Exact Mass | 186.16 |
| IUPAC Name | 2-(1-methoxyethoxy)ethylcyclohexane |
| SMILES | COC(C)OCCC1CCCCC1 |
| InChI | InChI=1S/C11H22O2/c1-10(12-2)13-9-8-11-6-4-3-5-7-11/h10-11H,3-9H2,1-2H3 |
| InChIKey | FOWUQGGHGFHMNR-UHFFFAOYSA-N |
| XLogP | 2.97 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 186.29 |
| LogP ≤ 5 | 2.97 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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 2-(1-methoxyethoxy)ethylcyclohexane?
The IUPAC name of 2-(1-methoxyethoxy)ethylcyclohexane (CID 21363344) is 2-(1-methoxyethoxy)ethylcyclohexane.
What is the SMILES notation for 2-(1-methoxyethoxy)ethylcyclohexane?
The canonical SMILES for 2-(1-methoxyethoxy)ethylcyclohexane is COC(C)OCCC1CCCCC1.
What is the InChIKey of 2-(1-methoxyethoxy)ethylcyclohexane?
The InChIKey is FOWUQGGHGFHMNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O2/c1-10(12-2)13-9-8-11-6-4-3-5-7-11/h10-11H,3-9H2,1-2H3.
What are the key properties of 2-(1-methoxyethoxy)ethylcyclohexane?
2-(1-methoxyethoxy)ethylcyclohexane has a molecular weight of 186.29 g/mol, XLogP of 2.97, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxyethoxy)ethylcyclohexane is sourced from PubChem (CID 21363344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).