bis[[dimethyl-[3-(2-triethylsilyloxyethoxy)propyl]silyl]oxy]-dimethylsilane

C28H68O6Si5 — CID 161123400

About bis[[dimethyl-[3-(2-triethylsilyloxyethoxy)propyl]silyl]oxy]-dimethylsilane

bis[[dimethyl-[3-(2-triethylsilyloxyethoxy)propyl]silyl]oxy]-dimethylsilane (PubChem CID 161123400) has the molecular formula C28H68O6Si5 and a molecular weight of 641.28 g/mol. Its IUPAC name is bis[[dimethyl-[3-(2-triethylsilyloxyethoxy)propyl]silyl]oxy]-dimethylsilane.

Molecular Properties

• Compound Name: bis[[dimethyl-[3-(2-triethylsilyloxyethoxy)propyl]silyl]oxy]-dimethylsilane
• PubChem CID: 161123400
• Molecular Formula: C28H68O6Si5
• Molecular Weight: 641.28 g/mol
• Exact Mass: 640.39
• IUPAC Name: bis[[dimethyl-[3-(2-triethylsilyloxyethoxy)propyl]silyl]oxy]-dimethylsilane
• SMILES: CC[Si](CC)(CC)OCCOCCC[Si](C)(C)O[Si](C)(C)O[Si](C)(C)CCCOCCO[Si](CC)(CC)CC
• InChI: InChI=1S/C28H68O6Si5/c1-13-38(14-2,15-3)31-25-23-29-21-19-27-35(7,8)33-37(11,12)34-36(9,10)28-20-22-30-24-26-32-39(16-4,17-5)18-6/h13-28H2,1-12H3
• InChIKey: WGYZLRBYWJDUGG-UHFFFAOYSA-N
• XLogP: 8.99
• TPSA: 55.38 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 26
• Heavy Atoms: 39
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	641.28
LogP ≤ 5	8.99
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of bis[[dimethyl-[3-(2-triethylsilyloxyethoxy)propyl]silyl]oxy]-dimethylsilane?

The IUPAC name of bis[[dimethyl-[3-(2-triethylsilyloxyethoxy)propyl]silyl]oxy]-dimethylsilane (CID 161123400) is bis[[dimethyl-[3-(2-triethylsilyloxyethoxy)propyl]silyl]oxy]-dimethylsilane.

What is the SMILES notation for bis[[dimethyl-[3-(2-triethylsilyloxyethoxy)propyl]silyl]oxy]-dimethylsilane?

The canonical SMILES for bis[[dimethyl-[3-(2-triethylsilyloxyethoxy)propyl]silyl]oxy]-dimethylsilane is CC[Si](CC)(CC)OCCOCCC[Si](C)(C)O[Si](C)(C)O[Si](C)(C)CCCOCCO[Si](CC)(CC)CC.

What is the InChIKey of bis[[dimethyl-[3-(2-triethylsilyloxyethoxy)propyl]silyl]oxy]-dimethylsilane?

The InChIKey is WGYZLRBYWJDUGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H68O6Si5/c1-13-38(14-2,15-3)31-25-23-29-21-19-27-35(7,8)33-37(11,12)34-36(9,10)28-20-22-30-24-26-32-39(16-4,17-5)18-6/h13-28H2,1-12H3.

What are the key properties of bis[[dimethyl-[3-(2-triethylsilyloxyethoxy)propyl]silyl]oxy]-dimethylsilane?

bis[[dimethyl-[3-(2-triethylsilyloxyethoxy)propyl]silyl]oxy]-dimethylsilane has a molecular weight of 641.28 g/mol, XLogP of 8.99, 26 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for bis[[dimethyl-[3-(2-triethylsilyloxyethoxy)propyl]silyl]oxy]-dimethylsilane is sourced from PubChem (CID 161123400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).