trimethyl-[[11,14,17-tris(dimethylsilyloxy)-1,3,5,7,9,11,14,17-octakis-phenyl-2,4,6,8,10,12,13,15,16,18-decaoxa-1,3,5,7,9,11,14,17-octasilatricyclo[7.3.3.33,7]octadecan-5-yl]oxy]silane

C57H70O14Si12 — CID 123658212

About trimethyl-[[11,14,17-tris(dimethylsilyloxy)-1,3,5,7,9,11,14,17-octakis-phenyl-2,4,6,8,10,12,13,15,16,18-decaoxa-1,3,5,7,9,11,14,17-octasilatricyclo[7.3.3.33,7]octadecan-5-yl]oxy]silane

trimethyl-[[11,14,17-tris(dimethylsilyloxy)-1,3,5,7,9,11,14,17-octakis-phenyl-2,4,6,8,10,12,13,15,16,18-decaoxa-1,3,5,7,9,11,14,17-octasilatricyclo[7.3.3.33,7]octadecan-5-yl]oxy]silane (PubChem CID 123658212) has the molecular formula C57H70O14Si12 and a molecular weight of 1316.20 g/mol. Its IUPAC name is trimethyl-[[11,14,17-tris(dimethylsilyloxy)-1,3,5,7,9,11,14,17-octakis-phenyl-2,4,6,8,10,12,13,15,16,18-decaoxa-1,3,5,7,9,11,14,17-octasilatricyclo[7.3.3.33,7]octadecan-5-yl]oxy]silane.

Molecular Properties

• Compound Name: trimethyl-[[11,14,17-tris(dimethylsilyloxy)-1,3,5,7,9,11,14,17-octakis-phenyl-2,4,6,8,10,12,13,15,16,18-decaoxa-1,3,5,7,9,11,14,17-octasilatricyclo[7.3.3.33,7]octadecan-5-yl]oxy]silane
• PubChem CID: 123658212
• Molecular Formula: C57H70O14Si12
• Molecular Weight: 1316.20 g/mol
• Exact Mass: 1314.20
• IUPAC Name: trimethyl-[[11,14,17-tris(dimethylsilyloxy)-1,3,5,7,9,11,14,17-octakis-phenyl-2,4,6,8,10,12,13,15,16,18-decaoxa-1,3,5,7,9,11,14,17-octasilatricyclo[7.3.3.33,7]octadecan-5-yl]oxy]silane
• SMILES: C[SiH](C)O[Si]1(c2ccccc2)O[Si]2(c3ccccc3)O[Si](O[SiH](C)C)(c3ccccc3)O[Si](c3ccccc3)(O1)O[Si]1(c3ccccc3)O[Si](O[SiH](C)C)(c3ccccc3)O[Si](c3ccccc3)(O[Si](O[Si](C)(C)C)(c3ccccc3)O1)O2
• InChI: InChI=1S/C57H70O14Si12/c1-72(2)58-76(50-34-18-10-19-35-50)62-80(54-42-26-14-27-43-54)64-77(59-73(3)4,51-36-20-11-21-37-51)65-81(63-76,55-44-28-15-29-45-55)71-83(57-48-32-17-33-49-57)67-78(60-74(5)6,52-38-22-12-23-39-52)66-82(70-80,56-46-30-16-31-47-56)68-79(69-83,61-75(7,8)9)53-40-24-13-25-41-53/h10-49,72-74H,1-9H3
• InChIKey: UFRXUQOQKSULLB-UHFFFAOYSA-N
• XLogP: 5.81
• TPSA: 129.22 Ų
• H-Bond Acceptors: 14
• Rotatable Bonds: 16
• Heavy Atoms: 83
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1316.20
LogP ≤ 5	5.81
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	14

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of trimethyl-[[11,14,17-tris(dimethylsilyloxy)-1,3,5,7,9,11,14,17-octakis-phenyl-2,4,6,8,10,12,13,15,16,18-decaoxa-1,3,5,7,9,11,14,17-octasilatricyclo[7.3.3.33,7]octadecan-5-yl]oxy]silane?

The IUPAC name of trimethyl-[[11,14,17-tris(dimethylsilyloxy)-1,3,5,7,9,11,14,17-octakis-phenyl-2,4,6,8,10,12,13,15,16,18-decaoxa-1,3,5,7,9,11,14,17-octasilatricyclo[7.3.3.33,7]octadecan-5-yl]oxy]silane (CID 123658212) is trimethyl-[[11,14,17-tris(dimethylsilyloxy)-1,3,5,7,9,11,14,17-octakis-phenyl-2,4,6,8,10,12,13,15,16,18-decaoxa-1,3,5,7,9,11,14,17-octasilatricyclo[7.3.3.33,7]octadecan-5-yl]oxy]silane.

What is the SMILES notation for trimethyl-[[11,14,17-tris(dimethylsilyloxy)-1,3,5,7,9,11,14,17-octakis-phenyl-2,4,6,8,10,12,13,15,16,18-decaoxa-1,3,5,7,9,11,14,17-octasilatricyclo[7.3.3.33,7]octadecan-5-yl]oxy]silane?

The canonical SMILES for trimethyl-[[11,14,17-tris(dimethylsilyloxy)-1,3,5,7,9,11,14,17-octakis-phenyl-2,4,6,8,10,12,13,15,16,18-decaoxa-1,3,5,7,9,11,14,17-octasilatricyclo[7.3.3.33,7]octadecan-5-yl]oxy]silane is C[SiH](C)O[Si]1(c2ccccc2)O[Si]2(c3ccccc3)O[Si](O[SiH](C)C)(c3ccccc3)O[Si](c3ccccc3)(O1)O[Si]1(c3ccccc3)O[Si](O[SiH](C)C)(c3ccccc3)O[Si](c3ccccc3)(O[Si](O[Si](C)(C)C)(c3ccccc3)O1)O2.

What is the InChIKey of trimethyl-[[11,14,17-tris(dimethylsilyloxy)-1,3,5,7,9,11,14,17-octakis-phenyl-2,4,6,8,10,12,13,15,16,18-decaoxa-1,3,5,7,9,11,14,17-octasilatricyclo[7.3.3.33,7]octadecan-5-yl]oxy]silane?

The InChIKey is UFRXUQOQKSULLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H70O14Si12/c1-72(2)58-76(50-34-18-10-19-35-50)62-80(54-42-26-14-27-43-54)64-77(59-73(3)4,51-36-20-11-21-37-51)65-81(63-76,55-44-28-15-29-45-55)71-83(57-48-32-17-33-49-57)67-78(60-74(5)6,52-38-22-12-23-39-52)66-82(70-80,56-46-30-16-31-47-56)68-79(69-83,61-75(7,8)9)53-40-24-13-25-41-53/h10-49,72-74H,1-9H3.

What are the key properties of trimethyl-[[11,14,17-tris(dimethylsilyloxy)-1,3,5,7,9,11,14,17-octakis-phenyl-2,4,6,8,10,12,13,15,16,18-decaoxa-1,3,5,7,9,11,14,17-octasilatricyclo[7.3.3.33,7]octadecan-5-yl]oxy]silane?

trimethyl-[[11,14,17-tris(dimethylsilyloxy)-1,3,5,7,9,11,14,17-octakis-phenyl-2,4,6,8,10,12,13,15,16,18-decaoxa-1,3,5,7,9,11,14,17-octasilatricyclo[7.3.3.33,7]octadecan-5-yl]oxy]silane has a molecular weight of 1316.20 g/mol, XLogP of 5.81, 16 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for trimethyl-[[11,14,17-tris(dimethylsilyloxy)-1,3,5,7,9,11,14,17-octakis-phenyl-2,4,6,8,10,12,13,15,16,18-decaoxa-1,3,5,7,9,11,14,17-octasilatricyclo[7.3.3.33,7]octadecan-5-yl]oxy]silane is sourced from PubChem (CID 123658212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).