About propan-2-yloxymethylsilane
propan-2-yloxymethylsilane (PubChem CID 123461984) has the molecular formula C4H12OSi
and a molecular weight of 104.23 g/mol. Its IUPAC name is propan-2-yloxymethylsilane.
Molecular Properties
| Compound Name | propan-2-yloxymethylsilane |
| PubChem CID | 123461984 |
| Molecular Formula | C4H12OSi |
| Molecular Weight | 104.23 g/mol |
| Exact Mass | 104.07 |
| IUPAC Name | propan-2-yloxymethylsilane |
| SMILES | CC(C)OC[SiH3] |
| InChI | InChI=1S/C4H12OSi/c1-4(2)5-3-6/h4H,3H2,1-2,6H3 |
| InChIKey | IQWCIRCAXYMICE-UHFFFAOYSA-N |
| XLogP | -0.27 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 6 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 104.23 |
| LogP ≤ 5 | -0.27 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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 propan-2-yloxymethylsilane?
The IUPAC name of propan-2-yloxymethylsilane (CID 123461984) is propan-2-yloxymethylsilane.
What is the SMILES notation for propan-2-yloxymethylsilane?
The canonical SMILES for propan-2-yloxymethylsilane is CC(C)OC[SiH3].
What is the InChIKey of propan-2-yloxymethylsilane?
The InChIKey is IQWCIRCAXYMICE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12OSi/c1-4(2)5-3-6/h4H,3H2,1-2,6H3.
What are the key properties of propan-2-yloxymethylsilane?
propan-2-yloxymethylsilane has a molecular weight of 104.23 g/mol, XLogP of -0.27, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yloxymethylsilane is sourced from PubChem (CID 123461984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).