About 2-[dimethyl(silyloxy)silyl]ethylsilyloxy-[2-[2-[dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silyl]oxysilylethyl-dimethylsilyl]oxysilylethyl]-dimethylsilane
2-[dimethyl(silyloxy)silyl]ethylsilyloxy-[2-[2-[dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silyl]oxysilylethyl-dimethylsilyl]oxysilylethyl]-dimethylsilane (PubChem CID 123402667) has the molecular formula C25H76O7Si12
and a molecular weight of 825.91 g/mol. Its IUPAC name is 2-[dimethyl(silyloxy)silyl]ethylsilyloxy-[2-[2-[dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silyl]oxysilylethyl-dimethylsilyl]oxysilylethyl]-dimethylsilane.
Molecular Properties
| Compound Name | 2-[dimethyl(silyloxy)silyl]ethylsilyloxy-[2-[2-[dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silyl]oxysilylethyl-dimethylsilyl]oxysilylethyl]-dimethylsilane |
| PubChem CID | 123402667 |
| Molecular Formula | C25H76O7Si12 |
| Molecular Weight | 825.91 g/mol |
| Exact Mass | 824.28 |
| IUPAC Name | 2-[dimethyl(silyloxy)silyl]ethylsilyloxy-[2-[2-[dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silyl]oxysilylethyl-dimethylsilyl]oxysilylethyl]-dimethylsilane |
| SMILES | C[Si](C)(C)O[Si](CC[Si](C)(C)O[SiH2]CC[Si](C)(C)O[SiH2]CC[Si](C)(C)O[SiH2]CC[Si](C)(C)O[SiH3])(O[Si](C)(C)C)O[Si](C)(C)C |
| InChI | InChI=1S/C25H76O7Si12/c1-37(2,3)30-44(31-38(4,5)6,32-39(7,8)9)25-24-43(16,17)29-36-20-23-42(14,15)28-35-19-22-41(12,13)27-34-18-21-40(10,11)26-33/h18-25,34-36H2,1-17,33H3 |
| InChIKey | BFZJOJRRMSNVBT-UHFFFAOYSA-N |
| XLogP | 6.15 |
| TPSA | 64.61 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 7 |
| Rotatable Bonds | 25 |
| Heavy Atoms | 44 |
| Complexity | — |
Lipinski Rule of Five
2 violations
| Rule | Value |
| MW ≤ 500 | 825.91 |
| LogP ≤ 5 | 6.15 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 7 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-[dimethyl(silyloxy)silyl]ethylsilyloxy-[2-[2-[dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silyl]oxysilylethyl-dimethylsilyl]oxysilylethyl]-dimethylsilane?
The IUPAC name of 2-[dimethyl(silyloxy)silyl]ethylsilyloxy-[2-[2-[dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silyl]oxysilylethyl-dimethylsilyl]oxysilylethyl]-dimethylsilane (CID 123402667) is 2-[dimethyl(silyloxy)silyl]ethylsilyloxy-[2-[2-[dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silyl]oxysilylethyl-dimethylsilyl]oxysilylethyl]-dimethylsilane.
What is the SMILES notation for 2-[dimethyl(silyloxy)silyl]ethylsilyloxy-[2-[2-[dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silyl]oxysilylethyl-dimethylsilyl]oxysilylethyl]-dimethylsilane?
The canonical SMILES for 2-[dimethyl(silyloxy)silyl]ethylsilyloxy-[2-[2-[dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silyl]oxysilylethyl-dimethylsilyl]oxysilylethyl]-dimethylsilane is C[Si](C)(C)O[Si](CC[Si](C)(C)O[SiH2]CC[Si](C)(C)O[SiH2]CC[Si](C)(C)O[SiH2]CC[Si](C)(C)O[SiH3])(O[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of 2-[dimethyl(silyloxy)silyl]ethylsilyloxy-[2-[2-[dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silyl]oxysilylethyl-dimethylsilyl]oxysilylethyl]-dimethylsilane?
The InChIKey is BFZJOJRRMSNVBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H76O7Si12/c1-37(2,3)30-44(31-38(4,5)6,32-39(7,8)9)25-24-43(16,17)29-36-20-23-42(14,15)28-35-19-22-41(12,13)27-34-18-21-40(10,11)26-33/h18-25,34-36H2,1-17,33H3.
What are the key properties of 2-[dimethyl(silyloxy)silyl]ethylsilyloxy-[2-[2-[dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silyl]oxysilylethyl-dimethylsilyl]oxysilylethyl]-dimethylsilane?
2-[dimethyl(silyloxy)silyl]ethylsilyloxy-[2-[2-[dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silyl]oxysilylethyl-dimethylsilyl]oxysilylethyl]-dimethylsilane has a molecular weight of 825.91 g/mol, XLogP of 6.15, 25 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[dimethyl(silyloxy)silyl]ethylsilyloxy-[2-[2-[dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silyl]oxysilylethyl-dimethylsilyl]oxysilylethyl]-dimethylsilane is sourced from PubChem (CID 123402667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).