About 2-cyclododecylideneethyl(triethyl)silane
2-cyclododecylideneethyl(triethyl)silane (PubChem CID 154721166) has the molecular formula C20H40Si
and a molecular weight of 308.63 g/mol. Its IUPAC name is 2-cyclododecylideneethyl(triethyl)silane.
Molecular Properties
| Compound Name | 2-cyclododecylideneethyl(triethyl)silane |
| PubChem CID | 154721166 |
| Molecular Formula | C20H40Si |
| Molecular Weight | 308.63 g/mol |
| Exact Mass | 308.29 |
| IUPAC Name | 2-cyclododecylideneethyl(triethyl)silane |
| SMILES | CC[Si](CC)(CC)CC=C1CCCCCCCCCCC1 |
| InChI | InChI=1S/C20H40Si/c1-4-21(5-2,6-3)19-18-20-16-14-12-10-8-7-9-11-13-15-17-20/h18H,4-17,19H2,1-3H3 |
| InChIKey | QYLIEHJNBANFHT-UHFFFAOYSA-N |
| XLogP | 7.73 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 5 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 308.63 |
| LogP ≤ 5 | 7.73 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-cyclododecylideneethyl(triethyl)silane?
The IUPAC name of 2-cyclododecylideneethyl(triethyl)silane (CID 154721166) is 2-cyclododecylideneethyl(triethyl)silane.
What is the SMILES notation for 2-cyclododecylideneethyl(triethyl)silane?
The canonical SMILES for 2-cyclododecylideneethyl(triethyl)silane is CC[Si](CC)(CC)CC=C1CCCCCCCCCCC1.
What is the InChIKey of 2-cyclododecylideneethyl(triethyl)silane?
The InChIKey is QYLIEHJNBANFHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H40Si/c1-4-21(5-2,6-3)19-18-20-16-14-12-10-8-7-9-11-13-15-17-20/h18H,4-17,19H2,1-3H3.
What are the key properties of 2-cyclododecylideneethyl(triethyl)silane?
2-cyclododecylideneethyl(triethyl)silane has a molecular weight of 308.63 g/mol, XLogP of 7.73, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclododecylideneethyl(triethyl)silane is sourced from PubChem (CID 154721166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).