C107H276O35Si27 — CID 167694863
butyl-[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-(3-triethoxysilylpropyl)silyl]oxy-methyl-trimethylsilyloxysilane;2-[3-[[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-(3-triethoxysilylpropyl)silyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]ethanol;2-[3-[[[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-(3-trimethylsilylpropyl)silyl]oxy-methyl-(3-triethoxysilylpropyl)silyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]ethanol;2-[3-[methyl-[methyl-[methyl-trimethylsilyloxy-(3-trimethylsilylpropyl)silyl]oxy-(3-triethoxysilylpropyl)silyl]oxy-trimethylsilyloxysilyl]propoxy]ethanol (PubChem CID 167694863) has the molecular formula C107H276O35Si27 and a molecular weight of 2881.67 g/mol. Its IUPAC name is butyl-[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-(3-triethoxysilylpropyl)silyl]oxy-methyl-trimethylsilyloxysilane;2-[3-[[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-(3-triethoxysilylpropyl)silyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]ethanol;2-[3-[[[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-(3-trimethylsilylpropyl)silyl]oxy-methyl-(3-triethoxysilylpropyl)silyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]ethanol;2-[3-[methyl-[methyl-[methyl-trimethylsilyloxy-(3-trimethylsilylpropyl)silyl]oxy-(3-triethoxysilylpropyl)silyl]oxy-trimethylsilyloxysilyl]propoxy]ethanol.
| Compound Name | butyl-[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-(3-triethoxysilylpropyl)silyl]oxy-methyl-trimethylsilyloxysilane;2-[3-[[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-(3-triethoxysilylpropyl)silyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]ethanol;2-[3-[[[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-(3-trimethylsilylpropyl)silyl]oxy-methyl-(3-triethoxysilylpropyl)silyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]ethanol;2-[3-[methyl-[methyl-[methyl-trimethylsilyloxy-(3-trimethylsilylpropyl)silyl]oxy-(3-triethoxysilylpropyl)silyl]oxy-trimethylsilyloxysilyl]propoxy]ethanol |
|---|---|
| PubChem CID | 167694863 |
| Molecular Formula | C107H276O35Si27 |
| Molecular Weight | 2881.67 g/mol |
| Exact Mass | 2877.36 |
| IUPAC Name | butyl-[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-(3-triethoxysilylpropyl)silyl]oxy-methyl-trimethylsilyloxysilane;2-[3-[[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-(3-triethoxysilylpropyl)silyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]ethanol;2-[3-[[[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-(3-trimethylsilylpropyl)silyl]oxy-methyl-(3-triethoxysilylpropyl)silyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]ethanol;2-[3-[methyl-[methyl-[methyl-trimethylsilyloxy-(3-trimethylsilylpropyl)silyl]oxy-(3-triethoxysilylpropyl)silyl]oxy-trimethylsilyloxysilyl]propoxy]ethanol |
| SMILES | CCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(CCC[Si](OCC)(OCC)OCC)O[Si](C)(C)O[Si](C)(C)C.CCO[Si](CCC[Si](C)(O[Si](C)(C)O[Si](C)(C)C)O[Si](C)(CCCOCCO)O[Si](C)(C)C)(OCC)OCC.CCO[Si](CCC[Si](C)(O[Si](C)(CCCOCCO)O[Si](C)(C)C)O[Si](C)(CCC[Si](C)(C)C)O[Si](C)(C)C)(OCC)OCC.CCO[Si](CCC[Si](C)(O[Si](C)(CCCOCCO)O[Si](C)(C)C)O[Si](C)(CCC[Si](C)(C)C)O[Si](C)(C)O[Si](C)(C)C)(OCC)OCC |
| InChI | InChI=1S/C31H80O10Si8.C29H74O9Si7.C24H62O9Si6.C23H60O7Si6/c1-18-34-49(35-19-2,36-20-3)31-23-30-48(17,40-46(15,38-44(10,11)12)28-21-25-33-26-24-32)41-47(16,29-22-27-42(4,5)6)39-45(13,14)37-43(7,8)9;1-16-32-45(33-17-2,34-18-3)29-21-28-44(15,37-42(13,35-40(7,8)9)26-19-23-31-24-22-30)38-43(14,36-41(10,11)12)27-20-25-39(4,5)6;1-14-27-39(28-15-2,29-16-3)24-18-23-38(13,32-36(10,11)30-34(4,5)6)33-37(12,31-35(7,8)9)22-17-20-26-21-19-25;1-15-19-21-34(13,28-32(8,9)10)30-35(14,29-33(11,12)27-31(5,6)7)22-20-23-36(24-16-2,25-17-3)26-18-4/h32H,18-31H2,1-17H3;30H,16-29H2,1-15H3;25H,14-24H2,1-13H3;15-23H2,1-14H3 |
| InChIKey | XMOLMGHOYWQWGK-UHFFFAOYSA-N |
| XLogP | 31.94 |
| TPSA | 356.05 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 35 |
| Rotatable Bonds | 103 |
| Heavy Atoms | 169 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2881.67 |
| LogP ≤ 5 | 31.94 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 35 |
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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