About 2-cyclopenta-1,3-dien-1-ylethyl(trimethyl)silane
2-cyclopenta-1,3-dien-1-ylethyl(trimethyl)silane (PubChem CID 70149774) has the molecular formula C10H18Si
and a molecular weight of 166.34 g/mol. Its IUPAC name is 2-cyclopenta-1,3-dien-1-ylethyl(trimethyl)silane.
Molecular Properties
| Compound Name | 2-cyclopenta-1,3-dien-1-ylethyl(trimethyl)silane |
| PubChem CID | 70149774 |
| Molecular Formula | C10H18Si |
| Molecular Weight | 166.34 g/mol |
| Exact Mass | 166.12 |
| IUPAC Name | 2-cyclopenta-1,3-dien-1-ylethyl(trimethyl)silane |
| SMILES | C[Si](C)(C)CCC1=CC=CC1 |
| InChI | InChI=1S/C10H18Si/c1-11(2,3)9-8-10-6-4-5-7-10/h4-6H,7-9H2,1-3H3 |
| InChIKey | KGCMPPGLYZGXPM-UHFFFAOYSA-N |
| XLogP | 3.60 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 3 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 166.34 |
| LogP ≤ 5 | 3.60 |
| 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 2-cyclopenta-1,3-dien-1-ylethyl(trimethyl)silane?
The IUPAC name of 2-cyclopenta-1,3-dien-1-ylethyl(trimethyl)silane (CID 70149774) is 2-cyclopenta-1,3-dien-1-ylethyl(trimethyl)silane.
What is the SMILES notation for 2-cyclopenta-1,3-dien-1-ylethyl(trimethyl)silane?
The canonical SMILES for 2-cyclopenta-1,3-dien-1-ylethyl(trimethyl)silane is C[Si](C)(C)CCC1=CC=CC1.
What is the InChIKey of 2-cyclopenta-1,3-dien-1-ylethyl(trimethyl)silane?
The InChIKey is KGCMPPGLYZGXPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18Si/c1-11(2,3)9-8-10-6-4-5-7-10/h4-6H,7-9H2,1-3H3.
What are the key properties of 2-cyclopenta-1,3-dien-1-ylethyl(trimethyl)silane?
2-cyclopenta-1,3-dien-1-ylethyl(trimethyl)silane has a molecular weight of 166.34 g/mol, XLogP of 3.60, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopenta-1,3-dien-1-ylethyl(trimethyl)silane is sourced from PubChem (CID 70149774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).