About 1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane
1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane (PubChem CID 139996962) has the molecular formula C14H28O2Si
and a molecular weight of 256.46 g/mol. Its IUPAC name is 1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane.
Molecular Properties
| Compound Name | 1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane |
| PubChem CID | 139996962 |
| Molecular Formula | C14H28O2Si |
| Molecular Weight | 256.46 g/mol |
| Exact Mass | 256.19 |
| IUPAC Name | 1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane |
| SMILES | CCO[Si](C)(CC1CC1)OC(C)C1CCCC1 |
| InChI | InChI=1S/C14H28O2Si/c1-4-15-17(3,11-13-9-10-13)16-12(2)14-7-5-6-8-14/h12-14H,4-11H2,1-3H3 |
| InChIKey | XIPKMXZQQYMZAN-UHFFFAOYSA-N |
| XLogP | 4.10 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 256.46 |
| LogP ≤ 5 | 4.10 |
| 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 1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane?
The IUPAC name of 1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane (CID 139996962) is 1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane.
What is the SMILES notation for 1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane?
The canonical SMILES for 1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane is CCO[Si](C)(CC1CC1)OC(C)C1CCCC1.
What is the InChIKey of 1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane?
The InChIKey is XIPKMXZQQYMZAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O2Si/c1-4-15-17(3,11-13-9-10-13)16-12(2)14-7-5-6-8-14/h12-14H,4-11H2,1-3H3.
What are the key properties of 1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane?
1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane has a molecular weight of 256.46 g/mol, XLogP of 4.10, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane is sourced from PubChem (CID 139996962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).