About triethyl-(4-methylphenyl)silane
triethyl-(4-methylphenyl)silane (PubChem CID 4588896) has the molecular formula C13H22Si
and a molecular weight of 206.41 g/mol. Its IUPAC name is triethyl-(4-methylphenyl)silane.
Molecular Properties
| Compound Name | triethyl-(4-methylphenyl)silane |
| PubChem CID | 4588896 |
| Molecular Formula | C13H22Si |
| Molecular Weight | 206.41 g/mol |
| Exact Mass | 206.15 |
| IUPAC Name | triethyl-(4-methylphenyl)silane |
| SMILES | CC[Si](CC)(CC)c1ccc(C)cc1 |
| InChI | InChI=1S/C13H22Si/c1-5-14(6-2,7-3)13-10-8-12(4)9-11-13/h8-11H,5-7H2,1-4H3 |
| InChIKey | QCMQECDEHTWDOM-UHFFFAOYSA-N |
| XLogP | 3.71 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 4 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 206.41 |
| LogP ≤ 5 | 3.71 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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-(4-methylphenyl)silane?
The IUPAC name of triethyl-(4-methylphenyl)silane (CID 4588896) is triethyl-(4-methylphenyl)silane.
What is the SMILES notation for triethyl-(4-methylphenyl)silane?
The canonical SMILES for triethyl-(4-methylphenyl)silane is CC[Si](CC)(CC)c1ccc(C)cc1.
What is the InChIKey of triethyl-(4-methylphenyl)silane?
The InChIKey is QCMQECDEHTWDOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22Si/c1-5-14(6-2,7-3)13-10-8-12(4)9-11-13/h8-11H,5-7H2,1-4H3.
What are the key properties of triethyl-(4-methylphenyl)silane?
triethyl-(4-methylphenyl)silane has a molecular weight of 206.41 g/mol, XLogP of 3.71, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-(4-methylphenyl)silane is sourced from PubChem (CID 4588896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).