About triethyl(3-methylidenenon-1-ynyl)silane
triethyl(3-methylidenenon-1-ynyl)silane (PubChem CID 24741057) has the molecular formula C16H30Si
and a molecular weight of 250.50 g/mol. Its IUPAC name is triethyl(3-methylidenenon-1-ynyl)silane.
Molecular Properties
| Compound Name | triethyl(3-methylidenenon-1-ynyl)silane |
| PubChem CID | 24741057 |
| Molecular Formula | C16H30Si |
| Molecular Weight | 250.50 g/mol |
| Exact Mass | 250.21 |
| IUPAC Name | triethyl(3-methylidenenon-1-ynyl)silane |
| SMILES | C=C(C#C[Si](CC)(CC)CC)CCCCCC |
| InChI | InChI=1S/C16H30Si/c1-6-10-11-12-13-16(5)14-15-17(7-2,8-3)9-4/h5-13H2,1-4H3 |
| InChIKey | XKWQKGFIHXQHFE-UHFFFAOYSA-N |
| XLogP | 5.56 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 8 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 250.50 |
| LogP ≤ 5 | 5.56 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', '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 triethyl(3-methylidenenon-1-ynyl)silane?
The IUPAC name of triethyl(3-methylidenenon-1-ynyl)silane (CID 24741057) is triethyl(3-methylidenenon-1-ynyl)silane.
What is the SMILES notation for triethyl(3-methylidenenon-1-ynyl)silane?
The canonical SMILES for triethyl(3-methylidenenon-1-ynyl)silane is C=C(C#C[Si](CC)(CC)CC)CCCCCC.
What is the InChIKey of triethyl(3-methylidenenon-1-ynyl)silane?
The InChIKey is XKWQKGFIHXQHFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30Si/c1-6-10-11-12-13-16(5)14-15-17(7-2,8-3)9-4/h5-13H2,1-4H3.
What are the key properties of triethyl(3-methylidenenon-1-ynyl)silane?
triethyl(3-methylidenenon-1-ynyl)silane has a molecular weight of 250.50 g/mol, XLogP of 5.56, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl(3-methylidenenon-1-ynyl)silane is sourced from PubChem (CID 24741057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).