About bis(ethoxy-[ethyl(dimethyl)silyl]oxy-dimethylsilane);ethoxy-[ethyl(diphenyl)silyl]oxy-diphenylsilane;ethoxy-(ethyl-methyl-phenylsilyl)oxy-methyl-phenylsilane;methane
bis(ethoxy-[ethyl(dimethyl)silyl]oxy-dimethylsilane);ethoxy-[ethyl(diphenyl)silyl]oxy-diphenylsilane;ethoxy-(ethyl-methyl-phenylsilyl)oxy-methyl-phenylsilane;methane (PubChem CID 159835033) has the molecular formula C86H196O8Si8
and a molecular weight of 1583.19 g/mol. Its IUPAC name is bis(ethoxy-[ethyl(dimethyl)silyl]oxy-dimethylsilane);ethoxy-[ethyl(diphenyl)silyl]oxy-diphenylsilane;ethoxy-(ethyl-methyl-phenylsilyl)oxy-methyl-phenylsilane;methane.
Molecular Properties
| Compound Name | bis(ethoxy-[ethyl(dimethyl)silyl]oxy-dimethylsilane);ethoxy-[ethyl(diphenyl)silyl]oxy-diphenylsilane;ethoxy-(ethyl-methyl-phenylsilyl)oxy-methyl-phenylsilane;methane |
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| PubChem CID | 159835033 |
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| Molecular Formula | C86H196O8Si8 |
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| Molecular Weight | 1583.19 g/mol |
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| Exact Mass | 1581.31 |
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| IUPAC Name | bis(ethoxy-[ethyl(dimethyl)silyl]oxy-dimethylsilane);ethoxy-[ethyl(diphenyl)silyl]oxy-diphenylsilane;ethoxy-(ethyl-methyl-phenylsilyl)oxy-methyl-phenylsilane;methane |
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| SMILES | C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CCO[Si](C)(C)O[Si](C)(C)CC.CCO[Si](C)(C)O[Si](C)(C)CC.CCO[Si](C)(O[Si](C)(CC)c1ccccc1)c1ccccc1.CCO[Si](O[Si](CC)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1 |
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| InChI | InChI=1S/C28H30O2Si2.C18H26O2Si2.2C8H22O2Si2.24CH4/c1-3-29-32(27-21-13-7-14-22-27,28-23-15-8-16-24-28)30-31(4-2,25-17-9-5-10-18-25)26-19-11-6-12-20-26;1-5-19-22(4,18-15-11-8-12-16-18)20-21(3,6-2)17-13-9-7-10-14-17;2*1-7-9-12(5,6)10-11(3,4)8-2;;;;;;;;;;;;;;;;;;;;;;;;/h5-24H,3-4H2,1-2H3;7-16H,5-6H2,1-4H3;2*7-8H2,1-6H3;24*1H4 |
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| InChIKey | NNYLPFKBYDLPIJ-UHFFFAOYSA-N |
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| XLogP | 28.80 |
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| TPSA | 73.84 Ų |
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| H-Bond Donors | |
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| H-Bond Acceptors | 8 |
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| Rotatable Bonds | 26 |
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| Heavy Atoms | 102 |
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| Complexity | — |
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Lipinski Rule of Five
2 violations
| Rule | Value |
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| MW ≤ 500 | 1583.19 |
| LogP ≤ 5 | 28.80 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 8 |
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 bis(ethoxy-[ethyl(dimethyl)silyl]oxy-dimethylsilane);ethoxy-[ethyl(diphenyl)silyl]oxy-diphenylsilane;ethoxy-(ethyl-methyl-phenylsilyl)oxy-methyl-phenylsilane;methane?
The IUPAC name of bis(ethoxy-[ethyl(dimethyl)silyl]oxy-dimethylsilane);ethoxy-[ethyl(diphenyl)silyl]oxy-diphenylsilane;ethoxy-(ethyl-methyl-phenylsilyl)oxy-methyl-phenylsilane;methane (CID 159835033) is bis(ethoxy-[ethyl(dimethyl)silyl]oxy-dimethylsilane);ethoxy-[ethyl(diphenyl)silyl]oxy-diphenylsilane;ethoxy-(ethyl-methyl-phenylsilyl)oxy-methyl-phenylsilane;methane.
What is the SMILES notation for bis(ethoxy-[ethyl(dimethyl)silyl]oxy-dimethylsilane);ethoxy-[ethyl(diphenyl)silyl]oxy-diphenylsilane;ethoxy-(ethyl-methyl-phenylsilyl)oxy-methyl-phenylsilane;methane?
The canonical SMILES for bis(ethoxy-[ethyl(dimethyl)silyl]oxy-dimethylsilane);ethoxy-[ethyl(diphenyl)silyl]oxy-diphenylsilane;ethoxy-(ethyl-methyl-phenylsilyl)oxy-methyl-phenylsilane;methane is C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CCO[Si](C)(C)O[Si](C)(C)CC.CCO[Si](C)(C)O[Si](C)(C)CC.CCO[Si](C)(O[Si](C)(CC)c1ccccc1)c1ccccc1.CCO[Si](O[Si](CC)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of bis(ethoxy-[ethyl(dimethyl)silyl]oxy-dimethylsilane);ethoxy-[ethyl(diphenyl)silyl]oxy-diphenylsilane;ethoxy-(ethyl-methyl-phenylsilyl)oxy-methyl-phenylsilane;methane?
The InChIKey is NNYLPFKBYDLPIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H30O2Si2.C18H26O2Si2.2C8H22O2Si2.24CH4/c1-3-29-32(27-21-13-7-14-22-27,28-23-15-8-16-24-28)30-31(4-2,25-17-9-5-10-18-25)26-19-11-6-12-20-26;1-5-19-22(4,18-15-11-8-12-16-18)20-21(3,6-2)17-13-9-7-10-14-17;2*1-7-9-12(5,6)10-11(3,4)8-2;;;;;;;;;;;;;;;;;;;;;;;;/h5-24H,3-4H2,1-2H3;7-16H,5-6H2,1-4H3;2*7-8H2,1-6H3;24*1H4.
What are the key properties of bis(ethoxy-[ethyl(dimethyl)silyl]oxy-dimethylsilane);ethoxy-[ethyl(diphenyl)silyl]oxy-diphenylsilane;ethoxy-(ethyl-methyl-phenylsilyl)oxy-methyl-phenylsilane;methane?
bis(ethoxy-[ethyl(dimethyl)silyl]oxy-dimethylsilane);ethoxy-[ethyl(diphenyl)silyl]oxy-diphenylsilane;ethoxy-(ethyl-methyl-phenylsilyl)oxy-methyl-phenylsilane;methane has a molecular weight of 1583.19 g/mol, XLogP of 28.80, 26 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for bis(ethoxy-[ethyl(dimethyl)silyl]oxy-dimethylsilane);ethoxy-[ethyl(diphenyl)silyl]oxy-diphenylsilane;ethoxy-(ethyl-methyl-phenylsilyl)oxy-methyl-phenylsilane;methane is sourced from PubChem (CID 159835033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).