QLB
2-[2-(2-octoxyethoxy)ethoxy]ethanol
| Created: | 2020-06-24 |
| Last modified: | 2021-05-05 |
Find Related PDB Entry |
|---|
Find related ligands: |
|---|
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 48 |
| Chiral Atom Count | 0 |
| Bond Count | 47 |
| Aromatic Bond Count | 0 |
Chemical Component Summary | |
|---|---|
| Name | 2-[2-(2-octoxyethoxy)ethoxy]ethanol |
| Systematic Name (OpenEye OEToolkits) | 2-[2-(2-octoxyethoxy)ethoxy]ethanol |
| Formula | C14 H30 O4 |
| Molecular Weight | 262.386 |
| Type | NON-POLYMER |
Chemical Descriptors | |||
|---|---|---|---|
| Type | Program | Version | Descriptor |
| SMILES | CACTVS | 3.385 | CCCCCCCCOCCOCCOCCO |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCCCCCCCOCCOCCOCCO |
| Canonical SMILES | CACTVS | 3.385 | CCCCCCCCOCCOCCOCCO |
| Canonical SMILES | OpenEye OEToolkits | 2.0.7 | CCCCCCCCOCCOCCOCCO |
| InChI | InChI | 1.03 | InChI=1S/C14H30O4/c1-2-3-4-5-6-7-9-16-11-13-18-14-12-17-10-8-15/h15H,2-14H2,1H3 |
| InChIKey | InChI | 1.03 | XIVLVYLYOMHUGB-UHFFFAOYSA-N |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 2723692 |














