About [(1Z)-1-cyclohexylhepta-1,6-dienoxy]-trimethylsilane
[(1Z)-1-cyclohexylhepta-1,6-dienoxy]-trimethylsilane (PubChem CID 10683211) has the molecular formula C16H30OSi
and a molecular weight of 266.50 g/mol. Its IUPAC name is [(1Z)-1-cyclohexylhepta-1,6-dienoxy]-trimethylsilane.
Molecular Properties
| Compound Name | [(1Z)-1-cyclohexylhepta-1,6-dienoxy]-trimethylsilane |
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| PubChem CID | 10683211 |
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| Molecular Formula | C16H30OSi |
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| Molecular Weight | 266.50 g/mol |
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| Exact Mass | 266.21 |
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| IUPAC Name | [(1Z)-1-cyclohexylhepta-1,6-dienoxy]-trimethylsilane |
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| SMILES | C=CCCC/C=C(\O[Si](C)(C)C)C1CCCCC1 |
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| InChI | InChI=1S/C16H30OSi/c1-5-6-7-11-14-16(17-18(2,3)4)15-12-9-8-10-13-15/h5,14-15H,1,6-13H2,2-4H3/b16-14- |
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| InChIKey | ZJKILDMONNTYIN-PEZBUJJGSA-N |
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| XLogP | 5.66 |
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| TPSA | 9.23 Ų |
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| H-Bond Donors | |
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| H-Bond Acceptors | 1 |
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| Rotatable Bonds | 7 |
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| Heavy Atoms | 18 |
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| Complexity | — |
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Lipinski Rule of Five
1 violation
| Rule | Value |
|---|
| MW ≤ 500 | 266.50 |
| LogP ≤ 5 | 5.66 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of [(1Z)-1-cyclohexylhepta-1,6-dienoxy]-trimethylsilane?
The IUPAC name of [(1Z)-1-cyclohexylhepta-1,6-dienoxy]-trimethylsilane (CID 10683211) is [(1Z)-1-cyclohexylhepta-1,6-dienoxy]-trimethylsilane.
What is the SMILES notation for [(1Z)-1-cyclohexylhepta-1,6-dienoxy]-trimethylsilane?
The canonical SMILES for [(1Z)-1-cyclohexylhepta-1,6-dienoxy]-trimethylsilane is C=CCCC/C=C(\O[Si](C)(C)C)C1CCCCC1.
What is the InChIKey of [(1Z)-1-cyclohexylhepta-1,6-dienoxy]-trimethylsilane?
The InChIKey is ZJKILDMONNTYIN-PEZBUJJGSA-N. The full InChI is InChI=1S/C16H30OSi/c1-5-6-7-11-14-16(17-18(2,3)4)15-12-9-8-10-13-15/h5,14-15H,1,6-13H2,2-4H3/b16-14-.
What are the key properties of [(1Z)-1-cyclohexylhepta-1,6-dienoxy]-trimethylsilane?
[(1Z)-1-cyclohexylhepta-1,6-dienoxy]-trimethylsilane has a molecular weight of 266.50 g/mol, XLogP of 5.66, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1Z)-1-cyclohexylhepta-1,6-dienoxy]-trimethylsilane is sourced from PubChem (CID 10683211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).