About diallylchlorosilane
diallylchlorosilane (PubChem CID 22667562) has the molecular formula C6H10ClSi
and a molecular weight of 145.68 g/mol.
Molecular Properties
| Compound Name | diallylchlorosilane |
| PubChem CID | 22667562 |
| Molecular Formula | C6H10ClSi |
| Molecular Weight | 145.68 g/mol |
| Exact Mass | 145.02 |
| IUPAC Name | — |
| SMILES | C=CC[Si](Cl)CC=C |
| InChI | InChI=1S/C6H10ClSi/c1-3-5-8(7)6-4-2/h3-4H,1-2,5-6H2 |
| InChIKey | YBKVXRLNLVUVTI-UHFFFAOYSA-N |
| XLogP | 2.59 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 4 |
| Heavy Atoms | 8 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 145.68 |
| LogP ≤ 5 | 2.59 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of diallylchlorosilane?
The IUPAC name of diallylchlorosilane (CID 22667562) is not available.
What is the SMILES notation for diallylchlorosilane?
The canonical SMILES for diallylchlorosilane is C=CC[Si](Cl)CC=C.
What is the InChIKey of diallylchlorosilane?
The InChIKey is YBKVXRLNLVUVTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10ClSi/c1-3-5-8(7)6-4-2/h3-4H,1-2,5-6H2.
What are the key properties of diallylchlorosilane?
diallylchlorosilane has a molecular weight of 145.68 g/mol, XLogP of 2.59, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for diallylchlorosilane is sourced from PubChem (CID 22667562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).