About 2-[2-[2-[2-(2-hydroxyethoxy)cyclohexyl]propyl]cyclohexyl]oxyethanol
2-[2-[2-[2-(2-hydroxyethoxy)cyclohexyl]propyl]cyclohexyl]oxyethanol (PubChem CID 151509941) has the molecular formula C19H36O4
and a molecular weight of 328.49 g/mol. Its IUPAC name is 2-[2-[2-[2-(2-hydroxyethoxy)cyclohexyl]propyl]cyclohexyl]oxyethanol.
Molecular Properties
| Compound Name | 2-[2-[2-[2-(2-hydroxyethoxy)cyclohexyl]propyl]cyclohexyl]oxyethanol |
| PubChem CID | 151509941 |
| Molecular Formula | C19H36O4 |
| Molecular Weight | 328.49 g/mol |
| Exact Mass | 328.26 |
| IUPAC Name | 2-[2-[2-[2-(2-hydroxyethoxy)cyclohexyl]propyl]cyclohexyl]oxyethanol |
| SMILES | CC(CC1CCCCC1OCCO)C1CCCCC1OCCO |
| InChI | InChI=1S/C19H36O4/c1-15(17-7-3-5-9-19(17)23-13-11-21)14-16-6-2-4-8-18(16)22-12-10-20/h15-21H,2-14H2,1H3 |
| InChIKey | PSFWGXPSPOHCIP-UHFFFAOYSA-N |
| XLogP | 3.15 |
| TPSA | 58.92 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 328.49 |
| LogP ≤ 5 | 3.15 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 2-[2-[2-[2-(2-hydroxyethoxy)cyclohexyl]propyl]cyclohexyl]oxyethanol?
The IUPAC name of 2-[2-[2-[2-(2-hydroxyethoxy)cyclohexyl]propyl]cyclohexyl]oxyethanol (CID 151509941) is 2-[2-[2-[2-(2-hydroxyethoxy)cyclohexyl]propyl]cyclohexyl]oxyethanol.
What is the SMILES notation for 2-[2-[2-[2-(2-hydroxyethoxy)cyclohexyl]propyl]cyclohexyl]oxyethanol?
The canonical SMILES for 2-[2-[2-[2-(2-hydroxyethoxy)cyclohexyl]propyl]cyclohexyl]oxyethanol is CC(CC1CCCCC1OCCO)C1CCCCC1OCCO.
What is the InChIKey of 2-[2-[2-[2-(2-hydroxyethoxy)cyclohexyl]propyl]cyclohexyl]oxyethanol?
The InChIKey is PSFWGXPSPOHCIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H36O4/c1-15(17-7-3-5-9-19(17)23-13-11-21)14-16-6-2-4-8-18(16)22-12-10-20/h15-21H,2-14H2,1H3.
What are the key properties of 2-[2-[2-[2-(2-hydroxyethoxy)cyclohexyl]propyl]cyclohexyl]oxyethanol?
2-[2-[2-[2-(2-hydroxyethoxy)cyclohexyl]propyl]cyclohexyl]oxyethanol has a molecular weight of 328.49 g/mol, XLogP of 3.15, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[2-(2-hydroxyethoxy)cyclohexyl]propyl]cyclohexyl]oxyethanol is sourced from PubChem (CID 151509941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).