About chloro-tris(2-chloroethyl)silane
chloro-tris(2-chloroethyl)silane (PubChem CID 140826950) has the molecular formula C6H12Cl4Si
and a molecular weight of 254.06 g/mol. Its IUPAC name is chloro-tris(2-chloroethyl)silane.
Molecular Properties
| Compound Name | chloro-tris(2-chloroethyl)silane |
| PubChem CID | 140826950 |
| Molecular Formula | C6H12Cl4Si |
| Molecular Weight | 254.06 g/mol |
| Exact Mass | 251.95 |
| IUPAC Name | chloro-tris(2-chloroethyl)silane |
| SMILES | ClCC[Si](Cl)(CCCl)CCCl |
| InChI | InChI=1S/C6H12Cl4Si/c7-1-4-11(10,5-2-8)6-3-9/h1-6H2 |
| InChIKey | MPEYLSOUQJBMQC-UHFFFAOYSA-N |
| XLogP | 3.89 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 6 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 254.06 |
| LogP ≤ 5 | 3.89 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of chloro-tris(2-chloroethyl)silane?
The IUPAC name of chloro-tris(2-chloroethyl)silane (CID 140826950) is chloro-tris(2-chloroethyl)silane.
What is the SMILES notation for chloro-tris(2-chloroethyl)silane?
The canonical SMILES for chloro-tris(2-chloroethyl)silane is ClCC[Si](Cl)(CCCl)CCCl.
What is the InChIKey of chloro-tris(2-chloroethyl)silane?
The InChIKey is MPEYLSOUQJBMQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12Cl4Si/c7-1-4-11(10,5-2-8)6-3-9/h1-6H2.
What are the key properties of chloro-tris(2-chloroethyl)silane?
chloro-tris(2-chloroethyl)silane has a molecular weight of 254.06 g/mol, XLogP of 3.89, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-tris(2-chloroethyl)silane is sourced from PubChem (CID 140826950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).