[dihexyl(trihexylsilyloxy)silyl]oxy-dihexyl-trihexylsilyloxysilane

C60H130O3Si4 — CID 141006663

IUPAC[dihexyl(trihexylsilyloxy)silyl]oxy-dihexyl-trihexylsilyloxysilane
SMILESCCCCCC[Si](CCCCCC)(CCCCCC)O[Si](CCCCCC)(CCCCCC)O[Si](CCCCCC)(CCCCCC)O[Si](CCCCCC)(CCCCCC)CCCCCC
InChIInChI=1S/C60H130O3Si4/c1-11-21-31-41-51-64(52-42-32-22-12-2,53-43-33-23-13-3)61-66(57-47-37-27-17-7,58-48-38-28-18-8)63-67(59-49-39-29-19-9,60-50-40-30-20-10)62-65(54-44-34-24-14-4,55-45-35-25-15-5)56-46-36-26-16-6/h11-60H2,1-10H3
InChIKeySQAGIWNOLOPJKR-UHFFFAOYSA-N
MW1012.04 g/mol
LogP23.61
Rot. Bonds56

About [dihexyl(trihexylsilyloxy)silyl]oxy-dihexyl-trihexylsilyloxysilane

[dihexyl(trihexylsilyloxy)silyl]oxy-dihexyl-trihexylsilyloxysilane (PubChem CID 141006663) has the molecular formula C60H130O3Si4 and a molecular weight of 1012.04 g/mol. Its IUPAC name is [dihexyl(trihexylsilyloxy)silyl]oxy-dihexyl-trihexylsilyloxysilane.

Molecular Properties

Compound Name[dihexyl(trihexylsilyloxy)silyl]oxy-dihexyl-trihexylsilyloxysilane
PubChem CID141006663
Molecular FormulaC60H130O3Si4
Molecular Weight1012.04 g/mol
Exact Mass1010.91
IUPAC Name[dihexyl(trihexylsilyloxy)silyl]oxy-dihexyl-trihexylsilyloxysilane
SMILESCCCCCC[Si](CCCCCC)(CCCCCC)O[Si](CCCCCC)(CCCCCC)O[Si](CCCCCC)(CCCCCC)O[Si](CCCCCC)(CCCCCC)CCCCCC
InChIInChI=1S/C60H130O3Si4/c1-11-21-31-41-51-64(52-42-32-22-12-2,53-43-33-23-13-3)61-66(57-47-37-27-17-7,58-48-38-28-18-8)63-67(59-49-39-29-19-9,60-50-40-30-20-10)62-65(54-44-34-24-14-4,55-45-35-25-15-5)56-46-36-26-16-6/h11-60H2,1-10H3
InChIKeySQAGIWNOLOPJKR-UHFFFAOYSA-N
XLogP23.61
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds56
Heavy Atoms67
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001012.04
LogP ≤ 523.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [dihexyl(trihexylsilyloxy)silyl]oxy-dihexyl-trihexylsilyloxysilane?
The IUPAC name of [dihexyl(trihexylsilyloxy)silyl]oxy-dihexyl-trihexylsilyloxysilane (CID 141006663) is [dihexyl(trihexylsilyloxy)silyl]oxy-dihexyl-trihexylsilyloxysilane.
What is the SMILES notation for [dihexyl(trihexylsilyloxy)silyl]oxy-dihexyl-trihexylsilyloxysilane?
The canonical SMILES for [dihexyl(trihexylsilyloxy)silyl]oxy-dihexyl-trihexylsilyloxysilane is CCCCCC[Si](CCCCCC)(CCCCCC)O[Si](CCCCCC)(CCCCCC)O[Si](CCCCCC)(CCCCCC)O[Si](CCCCCC)(CCCCCC)CCCCCC.
What is the InChIKey of [dihexyl(trihexylsilyloxy)silyl]oxy-dihexyl-trihexylsilyloxysilane?
The InChIKey is SQAGIWNOLOPJKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H130O3Si4/c1-11-21-31-41-51-64(52-42-32-22-12-2,53-43-33-23-13-3)61-66(57-47-37-27-17-7,58-48-38-28-18-8)63-67(59-49-39-29-19-9,60-50-40-30-20-10)62-65(54-44-34-24-14-4,55-45-35-25-15-5)56-46-36-26-16-6/h11-60H2,1-10H3.
What are the key properties of [dihexyl(trihexylsilyloxy)silyl]oxy-dihexyl-trihexylsilyloxysilane?
[dihexyl(trihexylsilyloxy)silyl]oxy-dihexyl-trihexylsilyloxysilane has a molecular weight of 1012.04 g/mol, XLogP of 23.61, 56 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [dihexyl(trihexylsilyloxy)silyl]oxy-dihexyl-trihexylsilyloxysilane is sourced from PubChem (CID 141006663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).