About triethoxy-[(1E)-1-(4-methylideneoxolan-3-ylidene)ethyl]silane
triethoxy-[(1E)-1-(4-methylideneoxolan-3-ylidene)ethyl]silane (PubChem CID 101268461) has the molecular formula C13H24O4Si
and a molecular weight of 272.42 g/mol. Its IUPAC name is triethoxy-[(1E)-1-(4-methylideneoxolan-3-ylidene)ethyl]silane.
Molecular Properties
| Compound Name | triethoxy-[(1E)-1-(4-methylideneoxolan-3-ylidene)ethyl]silane |
| PubChem CID | 101268461 |
| Molecular Formula | C13H24O4Si |
| Molecular Weight | 272.42 g/mol |
| Exact Mass | 272.14 |
| IUPAC Name | triethoxy-[(1E)-1-(4-methylideneoxolan-3-ylidene)ethyl]silane |
| SMILES | C=C1COC/C1=C(\C)[Si](OCC)(OCC)OCC |
| InChI | InChI=1S/C13H24O4Si/c1-6-15-18(16-7-2,17-8-3)12(5)13-10-14-9-11(13)4/h4,6-10H2,1-3,5H3/b13-12- |
| InChIKey | DVAPFRHRNGIDSS-SEYXRHQNSA-N |
| XLogP | 2.48 |
| TPSA | 36.92 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 272.42 |
| LogP ≤ 5 | 2.48 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |
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 triethoxy-[(1E)-1-(4-methylideneoxolan-3-ylidene)ethyl]silane?
The IUPAC name of triethoxy-[(1E)-1-(4-methylideneoxolan-3-ylidene)ethyl]silane (CID 101268461) is triethoxy-[(1E)-1-(4-methylideneoxolan-3-ylidene)ethyl]silane.
What is the SMILES notation for triethoxy-[(1E)-1-(4-methylideneoxolan-3-ylidene)ethyl]silane?
The canonical SMILES for triethoxy-[(1E)-1-(4-methylideneoxolan-3-ylidene)ethyl]silane is C=C1COC/C1=C(\C)[Si](OCC)(OCC)OCC.
What is the InChIKey of triethoxy-[(1E)-1-(4-methylideneoxolan-3-ylidene)ethyl]silane?
The InChIKey is DVAPFRHRNGIDSS-SEYXRHQNSA-N. The full InChI is InChI=1S/C13H24O4Si/c1-6-15-18(16-7-2,17-8-3)12(5)13-10-14-9-11(13)4/h4,6-10H2,1-3,5H3/b13-12-.
What are the key properties of triethoxy-[(1E)-1-(4-methylideneoxolan-3-ylidene)ethyl]silane?
triethoxy-[(1E)-1-(4-methylideneoxolan-3-ylidene)ethyl]silane has a molecular weight of 272.42 g/mol, XLogP of 2.48, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy-[(1E)-1-(4-methylideneoxolan-3-ylidene)ethyl]silane is sourced from PubChem (CID 101268461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).