About trimethyl-[1-(oxiren-2-yl)oct-1-en-3-yloxy]silane
trimethyl-[1-(oxiren-2-yl)oct-1-en-3-yloxy]silane (PubChem CID 57093918) has the molecular formula C13H24O2Si
and a molecular weight of 240.42 g/mol. Its IUPAC name is trimethyl-[1-(oxiren-2-yl)oct-1-en-3-yloxy]silane.
Molecular Properties
| Compound Name | trimethyl-[1-(oxiren-2-yl)oct-1-en-3-yloxy]silane |
| PubChem CID | 57093918 |
| Molecular Formula | C13H24O2Si |
| Molecular Weight | 240.42 g/mol |
| Exact Mass | 240.15 |
| IUPAC Name | trimethyl-[1-(oxiren-2-yl)oct-1-en-3-yloxy]silane |
| SMILES | CCCCCC(C=CC1=CO1)O[Si](C)(C)C |
| InChI | InChI=1S/C13H24O2Si/c1-5-6-7-8-12(15-16(2,3)4)9-10-13-11-14-13/h9-12H,5-8H2,1-4H3 |
| InChIKey | WHBDYTMUKBJVFM-UHFFFAOYSA-N |
| XLogP | 4.21 |
| TPSA | 21.76 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 240.42 |
| LogP ≤ 5 | 4.21 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of trimethyl-[1-(oxiren-2-yl)oct-1-en-3-yloxy]silane?
The IUPAC name of trimethyl-[1-(oxiren-2-yl)oct-1-en-3-yloxy]silane (CID 57093918) is trimethyl-[1-(oxiren-2-yl)oct-1-en-3-yloxy]silane.
What is the SMILES notation for trimethyl-[1-(oxiren-2-yl)oct-1-en-3-yloxy]silane?
The canonical SMILES for trimethyl-[1-(oxiren-2-yl)oct-1-en-3-yloxy]silane is CCCCCC(C=CC1=CO1)O[Si](C)(C)C.
What is the InChIKey of trimethyl-[1-(oxiren-2-yl)oct-1-en-3-yloxy]silane?
The InChIKey is WHBDYTMUKBJVFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24O2Si/c1-5-6-7-8-12(15-16(2,3)4)9-10-13-11-14-13/h9-12H,5-8H2,1-4H3.
What are the key properties of trimethyl-[1-(oxiren-2-yl)oct-1-en-3-yloxy]silane?
trimethyl-[1-(oxiren-2-yl)oct-1-en-3-yloxy]silane has a molecular weight of 240.42 g/mol, XLogP of 4.21, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[1-(oxiren-2-yl)oct-1-en-3-yloxy]silane is sourced from PubChem (CID 57093918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).