About 5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane
5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane (PubChem CID 150891032) has the molecular formula C16H34O3
and a molecular weight of 274.44 g/mol. Its IUPAC name is 5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane.
Molecular Properties
| Compound Name | 5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane |
| PubChem CID | 150891032 |
| Molecular Formula | C16H34O3 |
| Molecular Weight | 274.44 g/mol |
| Exact Mass | 274.25 |
| IUPAC Name | 5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane |
| SMILES | CCCCC(CCCC)CCOCCOCCOC |
| InChI | InChI=1S/C16H34O3/c1-4-6-8-16(9-7-5-2)10-11-18-14-15-19-13-12-17-3/h16H,4-15H2,1-3H3 |
| InChIKey | KYAKZXNCWPBABX-UHFFFAOYSA-N |
| XLogP | 4.05 |
| TPSA | 27.69 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 15 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 274.44 |
| LogP ≤ 5 | 4.05 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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-(2-methoxyethoxy)ethoxy]ethyl]nonane?
The IUPAC name of 5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane (CID 150891032) is 5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane.
What is the SMILES notation for 5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane?
The canonical SMILES for 5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane is CCCCC(CCCC)CCOCCOCCOC.
What is the InChIKey of 5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane?
The InChIKey is KYAKZXNCWPBABX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34O3/c1-4-6-8-16(9-7-5-2)10-11-18-14-15-19-13-12-17-3/h16H,4-15H2,1-3H3.
What are the key properties of 5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane?
5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane has a molecular weight of 274.44 g/mol, XLogP of 4.05, 15 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane is sourced from PubChem (CID 150891032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).