About isocyano(trimethyl)silane
isocyano(trimethyl)silane (PubChem CID 22648882) has the molecular formula C4H9NSi
and a molecular weight of 99.21 g/mol. Its IUPAC name is isocyano(trimethyl)silane.
Molecular Properties
| Compound Name | isocyano(trimethyl)silane |
| PubChem CID | 22648882 |
| Molecular Formula | C4H9NSi |
| Molecular Weight | 99.21 g/mol |
| Exact Mass | 99.05 |
| IUPAC Name | isocyano(trimethyl)silane |
| SMILES | [C-]#[N+][Si](C)(C)C |
| InChI | InChI=1S/C4H9NSi/c1-5-6(2,3)4/h2-4H3 |
| InChIKey | QVMFXFXESKJSGE-UHFFFAOYSA-N |
| XLogP | 1.74 |
| TPSA | 4.36 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | |
| Heavy Atoms | 6 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 99.21 |
| LogP ≤ 5 | 1.74 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of isocyano(trimethyl)silane?
The IUPAC name of isocyano(trimethyl)silane (CID 22648882) is isocyano(trimethyl)silane.
What is the SMILES notation for isocyano(trimethyl)silane?
The canonical SMILES for isocyano(trimethyl)silane is [C-]#[N+][Si](C)(C)C.
What is the InChIKey of isocyano(trimethyl)silane?
The InChIKey is QVMFXFXESKJSGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NSi/c1-5-6(2,3)4/h2-4H3.
What are the key properties of isocyano(trimethyl)silane?
isocyano(trimethyl)silane has a molecular weight of 99.21 g/mol, XLogP of 1.74, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for isocyano(trimethyl)silane is sourced from PubChem (CID 22648882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).