About trimethyl(4-trimethylsilyloxybut-2-ynoxy)silane
trimethyl(4-trimethylsilyloxybut-2-ynoxy)silane (PubChem CID 589995) has the molecular formula C10H22O2Si2
and a molecular weight of 230.46 g/mol. Its IUPAC name is trimethyl(4-trimethylsilyloxybut-2-ynoxy)silane.
Molecular Properties
| Compound Name | trimethyl(4-trimethylsilyloxybut-2-ynoxy)silane |
| PubChem CID | 589995 |
| Molecular Formula | C10H22O2Si2 |
| Molecular Weight | 230.46 g/mol |
| Exact Mass | 230.12 |
| IUPAC Name | trimethyl(4-trimethylsilyloxybut-2-ynoxy)silane |
| SMILES | C[Si](C)(C)OCC#CCO[Si](C)(C)C |
| InChI | InChI=1S/C10H22O2Si2/c1-13(2,3)11-9-7-8-10-12-14(4,5)6/h9-10H2,1-6H3 |
| InChIKey | CCSQYYBXROPSCM-UHFFFAOYSA-N |
| XLogP | 2.69 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 230.46 |
| LogP ≤ 5 | 2.69 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of trimethyl(4-trimethylsilyloxybut-2-ynoxy)silane?
The IUPAC name of trimethyl(4-trimethylsilyloxybut-2-ynoxy)silane (CID 589995) is trimethyl(4-trimethylsilyloxybut-2-ynoxy)silane.
What is the SMILES notation for trimethyl(4-trimethylsilyloxybut-2-ynoxy)silane?
The canonical SMILES for trimethyl(4-trimethylsilyloxybut-2-ynoxy)silane is C[Si](C)(C)OCC#CCO[Si](C)(C)C.
What is the InChIKey of trimethyl(4-trimethylsilyloxybut-2-ynoxy)silane?
The InChIKey is CCSQYYBXROPSCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O2Si2/c1-13(2,3)11-9-7-8-10-12-14(4,5)6/h9-10H2,1-6H3.
What are the key properties of trimethyl(4-trimethylsilyloxybut-2-ynoxy)silane?
trimethyl(4-trimethylsilyloxybut-2-ynoxy)silane has a molecular weight of 230.46 g/mol, XLogP of 2.69, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl(4-trimethylsilyloxybut-2-ynoxy)silane is sourced from PubChem (CID 589995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).