About 4-ethoxypent-1-ynyl(trimethyl)silane
4-ethoxypent-1-ynyl(trimethyl)silane (PubChem CID 135023128) has the molecular formula C10H19OSi+
and a molecular weight of 183.35 g/mol. Its IUPAC name is 4-ethoxypent-1-ynyl(trimethyl)silane.
Molecular Properties
| Compound Name | 4-ethoxypent-1-ynyl(trimethyl)silane |
| PubChem CID | 135023128 |
| Molecular Formula | C10H19OSi+ |
| Molecular Weight | 183.35 g/mol |
| Exact Mass | 183.12 |
| IUPAC Name | 4-ethoxypent-1-ynyl(trimethyl)silane |
| SMILES | C[CH+]OC(C)CC#C[Si](C)(C)C |
| InChI | InChI=1S/C10H19OSi/c1-6-11-10(2)8-7-9-12(3,4)5/h6,10H,8H2,1-5H3/q+1 |
| InChIKey | IMRHRLSFWDLMSA-UHFFFAOYSA-N |
| XLogP | 2.84 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 183.35 |
| LogP ≤ 5 | 2.84 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'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 4-ethoxypent-1-ynyl(trimethyl)silane?
The IUPAC name of 4-ethoxypent-1-ynyl(trimethyl)silane (CID 135023128) is 4-ethoxypent-1-ynyl(trimethyl)silane.
What is the SMILES notation for 4-ethoxypent-1-ynyl(trimethyl)silane?
The canonical SMILES for 4-ethoxypent-1-ynyl(trimethyl)silane is C[CH+]OC(C)CC#C[Si](C)(C)C.
What is the InChIKey of 4-ethoxypent-1-ynyl(trimethyl)silane?
The InChIKey is IMRHRLSFWDLMSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19OSi/c1-6-11-10(2)8-7-9-12(3,4)5/h6,10H,8H2,1-5H3/q+1.
What are the key properties of 4-ethoxypent-1-ynyl(trimethyl)silane?
4-ethoxypent-1-ynyl(trimethyl)silane has a molecular weight of 183.35 g/mol, XLogP of 2.84, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxypent-1-ynyl(trimethyl)silane is sourced from PubChem (CID 135023128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).