About [(Z)-but-2-enyl]-trichlorosilane
[(Z)-but-2-enyl]-trichlorosilane (PubChem CID 5364386) has the molecular formula C4H7Cl3Si
and a molecular weight of 189.54 g/mol. Its IUPAC name is [(Z)-but-2-enyl]-trichlorosilane.
Molecular Properties
| Compound Name | [(Z)-but-2-enyl]-trichlorosilane |
|---|
| PubChem CID | 5364386 |
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| Molecular Formula | C4H7Cl3Si |
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| Molecular Weight | 189.54 g/mol |
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| Exact Mass | 187.94 |
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| IUPAC Name | [(Z)-but-2-enyl]-trichlorosilane |
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| SMILES | C/C=C\C[Si](Cl)(Cl)Cl |
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| InChI | InChI=1S/C4H7Cl3Si/c1-2-3-4-8(5,6)7/h2-3H,4H2,1H3/b3-2- |
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| InChIKey | ZJDOJJKRTWHPOY-IHWYPQMZSA-N |
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| XLogP | 3.22 |
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| TPSA | 0.00 Ų |
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| H-Bond Donors | |
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| H-Bond Acceptors | |
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| Rotatable Bonds | 2 |
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| Heavy Atoms | 8 |
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| Complexity | — |
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Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|
| MW ≤ 500 | 189.54 |
| LogP ≤ 5 | 3.22 |
| 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 [(Z)-but-2-enyl]-trichlorosilane?
The IUPAC name of [(Z)-but-2-enyl]-trichlorosilane (CID 5364386) is [(Z)-but-2-enyl]-trichlorosilane.
What is the SMILES notation for [(Z)-but-2-enyl]-trichlorosilane?
The canonical SMILES for [(Z)-but-2-enyl]-trichlorosilane is C/C=C\C[Si](Cl)(Cl)Cl.
What is the InChIKey of [(Z)-but-2-enyl]-trichlorosilane?
The InChIKey is ZJDOJJKRTWHPOY-IHWYPQMZSA-N. The full InChI is InChI=1S/C4H7Cl3Si/c1-2-3-4-8(5,6)7/h2-3H,4H2,1H3/b3-2-.
What are the key properties of [(Z)-but-2-enyl]-trichlorosilane?
[(Z)-but-2-enyl]-trichlorosilane has a molecular weight of 189.54 g/mol, XLogP of 3.22, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-but-2-enyl]-trichlorosilane is sourced from PubChem (CID 5364386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).