About triethyl-(2-methyl-4-propan-2-yloxyphenyl)silane
triethyl-(2-methyl-4-propan-2-yloxyphenyl)silane (PubChem CID 171366290) has the molecular formula C16H28OSi
and a molecular weight of 264.49 g/mol. Its IUPAC name is triethyl-(2-methyl-4-propan-2-yloxyphenyl)silane.
Molecular Properties
| Compound Name | triethyl-(2-methyl-4-propan-2-yloxyphenyl)silane |
| PubChem CID | 171366290 |
| Molecular Formula | C16H28OSi |
| Molecular Weight | 264.49 g/mol |
| Exact Mass | 264.19 |
| IUPAC Name | triethyl-(2-methyl-4-propan-2-yloxyphenyl)silane |
| SMILES | CC[Si](CC)(CC)c1ccc(OC(C)C)cc1C |
| InChI | InChI=1S/C16H28OSi/c1-7-18(8-2,9-3)16-11-10-15(12-14(16)6)17-13(4)5/h10-13H,7-9H2,1-6H3 |
| InChIKey | OWFYGCVPYDQJPC-UHFFFAOYSA-N |
| XLogP | 4.50 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 264.49 |
| LogP ≤ 5 | 4.50 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of triethyl-(2-methyl-4-propan-2-yloxyphenyl)silane?
The IUPAC name of triethyl-(2-methyl-4-propan-2-yloxyphenyl)silane (CID 171366290) is triethyl-(2-methyl-4-propan-2-yloxyphenyl)silane.
What is the SMILES notation for triethyl-(2-methyl-4-propan-2-yloxyphenyl)silane?
The canonical SMILES for triethyl-(2-methyl-4-propan-2-yloxyphenyl)silane is CC[Si](CC)(CC)c1ccc(OC(C)C)cc1C.
What is the InChIKey of triethyl-(2-methyl-4-propan-2-yloxyphenyl)silane?
The InChIKey is OWFYGCVPYDQJPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28OSi/c1-7-18(8-2,9-3)16-11-10-15(12-14(16)6)17-13(4)5/h10-13H,7-9H2,1-6H3.
What are the key properties of triethyl-(2-methyl-4-propan-2-yloxyphenyl)silane?
triethyl-(2-methyl-4-propan-2-yloxyphenyl)silane has a molecular weight of 264.49 g/mol, XLogP of 4.50, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-(2-methyl-4-propan-2-yloxyphenyl)silane is sourced from PubChem (CID 171366290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).