2,4,6,8-tetrahexyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane

C28H64O4Si4 — CID 14933433

IUPAC2,4,6,8-tetrahexyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
SMILESCCCCCC[Si]1(C)O[Si](C)(CCCCCC)O[Si](C)(CCCCCC)O[Si](C)(CCCCCC)O1
InChIInChI=1S/C28H64O4Si4/c1-9-13-17-21-25-33(5)29-34(6,26-22-18-14-10-2)31-36(8,28-24-20-16-12-4)32-35(7,30-33)27-23-19-15-11-3/h9-28H2,1-8H3
InChIKeyAIBVLRZFJYOAGA-UHFFFAOYSA-N
MW577.16 g/mol
LogP10.68
Rot. Bonds20

About 2,4,6,8-tetrahexyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane

2,4,6,8-tetrahexyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane (PubChem CID 14933433) has the molecular formula C28H64O4Si4 and a molecular weight of 577.16 g/mol. Its IUPAC name is 2,4,6,8-tetrahexyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane.

Molecular Properties

Compound Name2,4,6,8-tetrahexyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
PubChem CID14933433
Molecular FormulaC28H64O4Si4
Molecular Weight577.16 g/mol
Exact Mass576.39
IUPAC Name2,4,6,8-tetrahexyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
SMILESCCCCCC[Si]1(C)O[Si](C)(CCCCCC)O[Si](C)(CCCCCC)O[Si](C)(CCCCCC)O1
InChIInChI=1S/C28H64O4Si4/c1-9-13-17-21-25-33(5)29-34(6,26-22-18-14-10-2)31-36(8,28-24-20-16-12-4)32-35(7,30-33)27-23-19-15-11-3/h9-28H2,1-8H3
InChIKeyAIBVLRZFJYOAGA-UHFFFAOYSA-N
XLogP10.68
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds20
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500577.16
LogP ≤ 510.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2,4,6,8-tetrahexyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,4,6,8-tetrahexyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane?
The IUPAC name of 2,4,6,8-tetrahexyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane (CID 14933433) is 2,4,6,8-tetrahexyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane.
What is the SMILES notation for 2,4,6,8-tetrahexyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane?
The canonical SMILES for 2,4,6,8-tetrahexyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane is CCCCCC[Si]1(C)O[Si](C)(CCCCCC)O[Si](C)(CCCCCC)O[Si](C)(CCCCCC)O1.
What is the InChIKey of 2,4,6,8-tetrahexyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane?
The InChIKey is AIBVLRZFJYOAGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H64O4Si4/c1-9-13-17-21-25-33(5)29-34(6,26-22-18-14-10-2)31-36(8,28-24-20-16-12-4)32-35(7,30-33)27-23-19-15-11-3/h9-28H2,1-8H3.
What are the key properties of 2,4,6,8-tetrahexyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane?
2,4,6,8-tetrahexyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane has a molecular weight of 577.16 g/mol, XLogP of 10.68, 20 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6,8-tetrahexyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane is sourced from PubChem (CID 14933433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).