About 1,4-Dimethylsilylethane
1,4-Dimethylsilylethane (PubChem CID 15810336) has the molecular formula C4H10Si2
and a molecular weight of 114.30 g/mol.
Molecular Properties
| Compound Name | 1,4-Dimethylsilylethane |
|---|
| PubChem CID | 15810336 |
|---|
| Molecular Formula | C4H10Si2 |
|---|
| Molecular Weight | 114.30 g/mol |
|---|
| Exact Mass | 114.03 |
|---|
| IUPAC Name | — |
|---|
| SMILES | C[Si]CC[Si]C |
|---|
| InChI | InChI=1S/C4H10Si2/c1-5-3-4-6-2/h3-4H2,1-2H3 |
|---|
| InChIKey | ZVAUGYMORQSGPT-UHFFFAOYSA-N |
|---|
| XLogP | 1.33 |
|---|
| TPSA | 0.00 Ų |
|---|
| H-Bond Donors | |
|---|
| H-Bond Acceptors | |
|---|
| Rotatable Bonds | 3 |
|---|
| Heavy Atoms | 6 |
|---|
| Complexity | — |
|---|
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|
| MW ≤ 500 | 114.30 |
| LogP ≤ 5 | 1.33 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
|---|
Analyze 1,4-Dimethylsilylethane with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of 1,4-Dimethylsilylethane?
The IUPAC name of 1,4-Dimethylsilylethane (CID 15810336) is not available.
What is the SMILES notation for 1,4-Dimethylsilylethane?
The canonical SMILES for 1,4-Dimethylsilylethane is C[Si]CC[Si]C.
What is the InChIKey of 1,4-Dimethylsilylethane?
The InChIKey is ZVAUGYMORQSGPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10Si2/c1-5-3-4-6-2/h3-4H2,1-2H3.
What are the key properties of 1,4-Dimethylsilylethane?
1,4-Dimethylsilylethane has a molecular weight of 114.30 g/mol, XLogP of 1.33, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-Dimethylsilylethane is sourced from PubChem (CID 15810336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).