About (1-Bromo-1-pentenyl)(trimethyl)silane
(1-Bromo-1-pentenyl)(trimethyl)silane (PubChem CID 5919681) has the molecular formula C8H17BrSi
and a molecular weight of 221.21 g/mol. Its IUPAC name is [(Z)-1-bromopent-1-enyl]-trimethylsilane.
Molecular Properties
| Compound Name | (1-Bromo-1-pentenyl)(trimethyl)silane |
|---|
| PubChem CID | 5919681 |
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| Molecular Formula | C8H17BrSi |
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| Molecular Weight | 221.21 g/mol |
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| Exact Mass | 220.03 |
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| IUPAC Name | [(Z)-1-bromopent-1-enyl]-trimethylsilane |
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| SMILES | CCC/C=C(/[Si](C)(C)C)\Br |
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| InChI | InChI=1S/C8H17BrSi/c1-5-6-7-8(9)10(2,3)4/h7H,5-6H2,1-4H3/b8-7+ |
|---|
| InChIKey | FIVBQDWAXIPGSL-BQYQJAHWSA-N |
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| XLogP | — |
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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 | 3 |
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| Heavy Atoms | 10 |
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| Complexity | 122 |
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Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|
| MW ≤ 500 | 221.21 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of (1-Bromo-1-pentenyl)(trimethyl)silane?
The IUPAC name of (1-Bromo-1-pentenyl)(trimethyl)silane (CID 5919681) is [(Z)-1-bromopent-1-enyl]-trimethylsilane.
What is the SMILES notation for (1-Bromo-1-pentenyl)(trimethyl)silane?
The canonical SMILES for (1-Bromo-1-pentenyl)(trimethyl)silane is CCC/C=C(/[Si](C)(C)C)\Br.
What is the InChIKey of (1-Bromo-1-pentenyl)(trimethyl)silane?
The InChIKey is FIVBQDWAXIPGSL-BQYQJAHWSA-N. The full InChI is InChI=1S/C8H17BrSi/c1-5-6-7-8(9)10(2,3)4/h7H,5-6H2,1-4H3/b8-7+.
What are the key properties of (1-Bromo-1-pentenyl)(trimethyl)silane?
(1-Bromo-1-pentenyl)(trimethyl)silane has a molecular weight of 221.21 g/mol, XLogP of not available, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1-Bromo-1-pentenyl)(trimethyl)silane is sourced from PubChem (CID 5919681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).