[2,3-diethyl-2-[methyl-tetradecyl-(2-trimethylsilylbutan-2-yloxy)silyl]pentan-3-yl]oxy-[4-[dimethyl(trimethylsilyloxy)silyl]oxy-3-ethyl-4-methylhexan-3-yl]-dodecyl-methylsilane

C58H128O4Si5 — CID 89473067

About [2,3-diethyl-2-[methyl-tetradecyl-(2-trimethylsilylbutan-2-yloxy)silyl]pentan-3-yl]oxy-[4-[dimethyl(trimethylsilyloxy)silyl]oxy-3-ethyl-4-methylhexan-3-yl]-dodecyl-methylsilane

[2,3-diethyl-2-[methyl-tetradecyl-(2-trimethylsilylbutan-2-yloxy)silyl]pentan-3-yl]oxy-[4-[dimethyl(trimethylsilyloxy)silyl]oxy-3-ethyl-4-methylhexan-3-yl]-dodecyl-methylsilane (PubChem CID 89473067) has the molecular formula C58H128O4Si5 and a molecular weight of 1030.09 g/mol. Its IUPAC name is [2,3-diethyl-2-[methyl-tetradecyl-(2-trimethylsilylbutan-2-yloxy)silyl]pentan-3-yl]oxy-[4-[dimethyl(trimethylsilyloxy)silyl]oxy-3-ethyl-4-methylhexan-3-yl]-dodecyl-methylsilane.

Molecular Properties

• Compound Name: [2,3-diethyl-2-[methyl-tetradecyl-(2-trimethylsilylbutan-2-yloxy)silyl]pentan-3-yl]oxy-[4-[dimethyl(trimethylsilyloxy)silyl]oxy-3-ethyl-4-methylhexan-3-yl]-dodecyl-methylsilane
• PubChem CID: 89473067
• Molecular Formula: C58H128O4Si5
• Molecular Weight: 1030.09 g/mol
• Exact Mass: 1028.87
• IUPAC Name: [2,3-diethyl-2-[methyl-tetradecyl-(2-trimethylsilylbutan-2-yloxy)silyl]pentan-3-yl]oxy-[4-[dimethyl(trimethylsilyloxy)silyl]oxy-3-ethyl-4-methylhexan-3-yl]-dodecyl-methylsilane
• SMILES: CCCCCCCCCCCCCC[Si](C)(OC(C)(CC)[Si](C)(C)C)C(C)(CC)C(CC)(CC)O[Si](C)(CCCCCCCCCCCC)C(CC)(CC)C(C)(CC)O[Si](C)(C)O[Si](C)(C)C
• InChI: InChI=1S/C58H128O4Si5/c1-23-32-34-36-38-40-42-43-45-46-48-50-52-66(21,60-56(12,27-5)63(13,14)15)55(11,26-4)57(28-6,29-7)61-67(22,53-51-49-47-44-41-39-37-35-33-24-2)58(30-8,31-9)54(10,25-3)59-65(19,20)62-64(16,17)18/h23-53H2,1-22H3
• InChIKey: YFMKOFCJZMHWON-UHFFFAOYSA-N
• XLogP: 21.87
• TPSA: 36.92 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 44
• Heavy Atoms: 67
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1030.09
LogP ≤ 5	21.87
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

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 [2,3-diethyl-2-[methyl-tetradecyl-(2-trimethylsilylbutan-2-yloxy)silyl]pentan-3-yl]oxy-[4-[dimethyl(trimethylsilyloxy)silyl]oxy-3-ethyl-4-methylhexan-3-yl]-dodecyl-methylsilane?

The IUPAC name of [2,3-diethyl-2-[methyl-tetradecyl-(2-trimethylsilylbutan-2-yloxy)silyl]pentan-3-yl]oxy-[4-[dimethyl(trimethylsilyloxy)silyl]oxy-3-ethyl-4-methylhexan-3-yl]-dodecyl-methylsilane (CID 89473067) is [2,3-diethyl-2-[methyl-tetradecyl-(2-trimethylsilylbutan-2-yloxy)silyl]pentan-3-yl]oxy-[4-[dimethyl(trimethylsilyloxy)silyl]oxy-3-ethyl-4-methylhexan-3-yl]-dodecyl-methylsilane.

What is the SMILES notation for [2,3-diethyl-2-[methyl-tetradecyl-(2-trimethylsilylbutan-2-yloxy)silyl]pentan-3-yl]oxy-[4-[dimethyl(trimethylsilyloxy)silyl]oxy-3-ethyl-4-methylhexan-3-yl]-dodecyl-methylsilane?

The canonical SMILES for [2,3-diethyl-2-[methyl-tetradecyl-(2-trimethylsilylbutan-2-yloxy)silyl]pentan-3-yl]oxy-[4-[dimethyl(trimethylsilyloxy)silyl]oxy-3-ethyl-4-methylhexan-3-yl]-dodecyl-methylsilane is CCCCCCCCCCCCCC[Si](C)(OC(C)(CC)[Si](C)(C)C)C(C)(CC)C(CC)(CC)O[Si](C)(CCCCCCCCCCCC)C(CC)(CC)C(C)(CC)O[Si](C)(C)O[Si](C)(C)C.

What is the InChIKey of [2,3-diethyl-2-[methyl-tetradecyl-(2-trimethylsilylbutan-2-yloxy)silyl]pentan-3-yl]oxy-[4-[dimethyl(trimethylsilyloxy)silyl]oxy-3-ethyl-4-methylhexan-3-yl]-dodecyl-methylsilane?

The InChIKey is YFMKOFCJZMHWON-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H128O4Si5/c1-23-32-34-36-38-40-42-43-45-46-48-50-52-66(21,60-56(12,27-5)63(13,14)15)55(11,26-4)57(28-6,29-7)61-67(22,53-51-49-47-44-41-39-37-35-33-24-2)58(30-8,31-9)54(10,25-3)59-65(19,20)62-64(16,17)18/h23-53H2,1-22H3.

What are the key properties of [2,3-diethyl-2-[methyl-tetradecyl-(2-trimethylsilylbutan-2-yloxy)silyl]pentan-3-yl]oxy-[4-[dimethyl(trimethylsilyloxy)silyl]oxy-3-ethyl-4-methylhexan-3-yl]-dodecyl-methylsilane?

[2,3-diethyl-2-[methyl-tetradecyl-(2-trimethylsilylbutan-2-yloxy)silyl]pentan-3-yl]oxy-[4-[dimethyl(trimethylsilyloxy)silyl]oxy-3-ethyl-4-methylhexan-3-yl]-dodecyl-methylsilane has a molecular weight of 1030.09 g/mol, XLogP of 21.87, 44 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for [2,3-diethyl-2-[methyl-tetradecyl-(2-trimethylsilylbutan-2-yloxy)silyl]pentan-3-yl]oxy-[4-[dimethyl(trimethylsilyloxy)silyl]oxy-3-ethyl-4-methylhexan-3-yl]-dodecyl-methylsilane is sourced from PubChem (CID 89473067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).