About 2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane
2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane (PubChem CID 142630702) has the molecular formula C19H34O3Si
and a molecular weight of 338.56 g/mol. Its IUPAC name is 2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane.
Molecular Properties
| Compound Name | 2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane |
| PubChem CID | 142630702 |
| Molecular Formula | C19H34O3Si |
| Molecular Weight | 338.56 g/mol |
| Exact Mass | 338.23 |
| IUPAC Name | 2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane |
| SMILES | CC(C)[Si](OCCOCCOc1ccccc1)(C(C)C)C(C)C |
| InChI | InChI=1S/C19H34O3Si/c1-16(2)23(17(3)4,18(5)6)22-15-13-20-12-14-21-19-10-8-7-9-11-19/h7-11,16-18H,12-15H2,1-6H3 |
| InChIKey | CEIGDBOMZZMXCC-UHFFFAOYSA-N |
| XLogP | 5.27 |
| TPSA | 27.69 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 338.56 |
| LogP ≤ 5 | 5.27 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane?
The IUPAC name of 2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane (CID 142630702) is 2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane.
What is the SMILES notation for 2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane?
The canonical SMILES for 2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane is CC(C)[Si](OCCOCCOc1ccccc1)(C(C)C)C(C)C.
What is the InChIKey of 2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane?
The InChIKey is CEIGDBOMZZMXCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34O3Si/c1-16(2)23(17(3)4,18(5)6)22-15-13-20-12-14-21-19-10-8-7-9-11-19/h7-11,16-18H,12-15H2,1-6H3.
What are the key properties of 2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane?
2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane has a molecular weight of 338.56 g/mol, XLogP of 5.27, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane is sourced from PubChem (CID 142630702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).