dimethyl-[methyl-[methyl-[methyl-(2-propoxyethoxymethyl)-trimethylsilyloxysilyl]oxysilyl]oxy-phenylsilyl]oxy-trimethylsilyloxysilane;methane

C31H84O7Si6 — CID 158098647

About dimethyl-[methyl-[methyl-[methyl-(2-propoxyethoxymethyl)-trimethylsilyloxysilyl]oxysilyl]oxy-phenylsilyl]oxy-trimethylsilyloxysilane;methane

dimethyl-[methyl-[methyl-[methyl-(2-propoxyethoxymethyl)-trimethylsilyloxysilyl]oxysilyl]oxy-phenylsilyl]oxy-trimethylsilyloxysilane;methane (PubChem CID 158098647) has the molecular formula C31H84O7Si6 and a molecular weight of 737.52 g/mol. Its IUPAC name is dimethyl-[methyl-[methyl-[methyl-(2-propoxyethoxymethyl)-trimethylsilyloxysilyl]oxysilyl]oxy-phenylsilyl]oxy-trimethylsilyloxysilane;methane.

Molecular Properties

• Compound Name: dimethyl-[methyl-[methyl-[methyl-(2-propoxyethoxymethyl)-trimethylsilyloxysilyl]oxysilyl]oxy-phenylsilyl]oxy-trimethylsilyloxysilane;methane
• PubChem CID: 158098647
• Molecular Formula: C31H84O7Si6
• Molecular Weight: 737.52 g/mol
• Exact Mass: 736.48
• IUPAC Name: dimethyl-[methyl-[methyl-[methyl-(2-propoxyethoxymethyl)-trimethylsilyloxysilyl]oxysilyl]oxy-phenylsilyl]oxy-trimethylsilyloxysilane;methane
• SMILES: C.C.C.C.C.C.C.C.CCCOCCOC[Si](C)(O[SiH](C)O[Si](C)(O[Si](C)(C)O[Si](C)(C)C)c1ccccc1)O[Si](C)(C)C
• InChI: InChI=1S/C23H52O7Si6.8CH4/c1-13-19-24-20-21-25-22-35(11,29-33(6,7)8)26-31(2)27-36(12,23-17-15-14-16-18-23)30-34(9,10)28-32(3,4)5;;;;;;;;/h14-18,31H,13,19-22H2,1-12H3;8*1H4
• InChIKey: FOZBEMDOOCZCCT-UHFFFAOYSA-N
• XLogP: 10.41
• TPSA: 64.61 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 18
• Heavy Atoms: 44
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	737.52
LogP ≤ 5	10.41
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'}

Frequently Asked Questions

What is the IUPAC name of dimethyl-[methyl-[methyl-[methyl-(2-propoxyethoxymethyl)-trimethylsilyloxysilyl]oxysilyl]oxy-phenylsilyl]oxy-trimethylsilyloxysilane;methane?

The IUPAC name of dimethyl-[methyl-[methyl-[methyl-(2-propoxyethoxymethyl)-trimethylsilyloxysilyl]oxysilyl]oxy-phenylsilyl]oxy-trimethylsilyloxysilane;methane (CID 158098647) is dimethyl-[methyl-[methyl-[methyl-(2-propoxyethoxymethyl)-trimethylsilyloxysilyl]oxysilyl]oxy-phenylsilyl]oxy-trimethylsilyloxysilane;methane.

What is the SMILES notation for dimethyl-[methyl-[methyl-[methyl-(2-propoxyethoxymethyl)-trimethylsilyloxysilyl]oxysilyl]oxy-phenylsilyl]oxy-trimethylsilyloxysilane;methane?

The canonical SMILES for dimethyl-[methyl-[methyl-[methyl-(2-propoxyethoxymethyl)-trimethylsilyloxysilyl]oxysilyl]oxy-phenylsilyl]oxy-trimethylsilyloxysilane;methane is C.C.C.C.C.C.C.C.CCCOCCOC[Si](C)(O[SiH](C)O[Si](C)(O[Si](C)(C)O[Si](C)(C)C)c1ccccc1)O[Si](C)(C)C.

What is the InChIKey of dimethyl-[methyl-[methyl-[methyl-(2-propoxyethoxymethyl)-trimethylsilyloxysilyl]oxysilyl]oxy-phenylsilyl]oxy-trimethylsilyloxysilane;methane?

The InChIKey is FOZBEMDOOCZCCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H52O7Si6.8CH4/c1-13-19-24-20-21-25-22-35(11,29-33(6,7)8)26-31(2)27-36(12,23-17-15-14-16-18-23)30-34(9,10)28-32(3,4)5;;;;;;;;/h14-18,31H,13,19-22H2,1-12H3;8*1H4.

What are the key properties of dimethyl-[methyl-[methyl-[methyl-(2-propoxyethoxymethyl)-trimethylsilyloxysilyl]oxysilyl]oxy-phenylsilyl]oxy-trimethylsilyloxysilane;methane?

dimethyl-[methyl-[methyl-[methyl-(2-propoxyethoxymethyl)-trimethylsilyloxysilyl]oxysilyl]oxy-phenylsilyl]oxy-trimethylsilyloxysilane;methane has a molecular weight of 737.52 g/mol, XLogP of 10.41, 18 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for dimethyl-[methyl-[methyl-[methyl-(2-propoxyethoxymethyl)-trimethylsilyloxysilyl]oxysilyl]oxy-phenylsilyl]oxy-trimethylsilyloxysilane;methane is sourced from PubChem (CID 158098647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).