About 2-bicyclo[2.2.1]heptanyl-cyclopentyl-dimethoxysilane
2-bicyclo[2.2.1]heptanyl-cyclopentyl-dimethoxysilane (PubChem CID 139668826) has the molecular formula C14H26O2Si
and a molecular weight of 254.45 g/mol. Its IUPAC name is 2-bicyclo[2.2.1]heptanyl-cyclopentyl-dimethoxysilane.
Molecular Properties
| Compound Name | 2-bicyclo[2.2.1]heptanyl-cyclopentyl-dimethoxysilane |
| PubChem CID | 139668826 |
| Molecular Formula | C14H26O2Si |
| Molecular Weight | 254.45 g/mol |
| Exact Mass | 254.17 |
| IUPAC Name | 2-bicyclo[2.2.1]heptanyl-cyclopentyl-dimethoxysilane |
| SMILES | CO[Si](OC)(C1CCCC1)C1CC2CCC1C2 |
| InChI | InChI=1S/C14H26O2Si/c1-15-17(16-2,13-5-3-4-6-13)14-10-11-7-8-12(14)9-11/h11-14H,3-10H2,1-2H3 |
| InChIKey | QEOYTMOKLCHUMJ-UHFFFAOYSA-N |
| XLogP | 3.86 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 254.45 |
| LogP ≤ 5 | 3.86 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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-bicyclo[2.2.1]heptanyl-cyclopentyl-dimethoxysilane?
The IUPAC name of 2-bicyclo[2.2.1]heptanyl-cyclopentyl-dimethoxysilane (CID 139668826) is 2-bicyclo[2.2.1]heptanyl-cyclopentyl-dimethoxysilane.
What is the SMILES notation for 2-bicyclo[2.2.1]heptanyl-cyclopentyl-dimethoxysilane?
The canonical SMILES for 2-bicyclo[2.2.1]heptanyl-cyclopentyl-dimethoxysilane is CO[Si](OC)(C1CCCC1)C1CC2CCC1C2.
What is the InChIKey of 2-bicyclo[2.2.1]heptanyl-cyclopentyl-dimethoxysilane?
The InChIKey is QEOYTMOKLCHUMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O2Si/c1-15-17(16-2,13-5-3-4-6-13)14-10-11-7-8-12(14)9-11/h11-14H,3-10H2,1-2H3.
What are the key properties of 2-bicyclo[2.2.1]heptanyl-cyclopentyl-dimethoxysilane?
2-bicyclo[2.2.1]heptanyl-cyclopentyl-dimethoxysilane has a molecular weight of 254.45 g/mol, XLogP of 3.86, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bicyclo[2.2.1]heptanyl-cyclopentyl-dimethoxysilane is sourced from PubChem (CID 139668826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).