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

C24H56O4Si4 — CID 142697059

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

2,4,6,8-tetramethyl-2,4,6,8-tetrapentyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane (PubChem CID 142697059) has the molecular formula C24H56O4Si4 and a molecular weight of 521.05 g/mol. Its IUPAC name is 2,4,6,8-tetramethyl-2,4,6,8-tetrapentyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane.

Molecular Properties

• Compound Name: 2,4,6,8-tetramethyl-2,4,6,8-tetrapentyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
• PubChem CID: 142697059
• Molecular Formula: C24H56O4Si4
• Molecular Weight: 521.05 g/mol
• Exact Mass: 520.33
• IUPAC Name: 2,4,6,8-tetramethyl-2,4,6,8-tetrapentyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
• SMILES: CCCCC[Si]1(C)O[Si](C)(CCCCC)O[Si](C)(CCCCC)O[Si](C)(CCCCC)O1
• InChI: InChI=1S/C24H56O4Si4/c1-9-13-17-21-29(5)25-30(6,22-18-14-10-2)27-32(8,24-20-16-12-4)28-31(7,26-29)23-19-15-11-3/h9-24H2,1-8H3
• InChIKey: MIURUSQMHYEDPT-UHFFFAOYSA-N
• XLogP: 9.12
• TPSA: 36.92 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 16
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	521.05
LogP ≤ 5	9.12
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 2,4,6,8-tetramethyl-2,4,6,8-tetrapentyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane?

The IUPAC name of 2,4,6,8-tetramethyl-2,4,6,8-tetrapentyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane (CID 142697059) is 2,4,6,8-tetramethyl-2,4,6,8-tetrapentyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane.

What is the SMILES notation for 2,4,6,8-tetramethyl-2,4,6,8-tetrapentyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane?

The canonical SMILES for 2,4,6,8-tetramethyl-2,4,6,8-tetrapentyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane is CCCCC[Si]1(C)O[Si](C)(CCCCC)O[Si](C)(CCCCC)O[Si](C)(CCCCC)O1.

What is the InChIKey of 2,4,6,8-tetramethyl-2,4,6,8-tetrapentyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane?

The InChIKey is MIURUSQMHYEDPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H56O4Si4/c1-9-13-17-21-29(5)25-30(6,22-18-14-10-2)27-32(8,24-20-16-12-4)28-31(7,26-29)23-19-15-11-3/h9-24H2,1-8H3.

What are the key properties of 2,4,6,8-tetramethyl-2,4,6,8-tetrapentyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane?

2,4,6,8-tetramethyl-2,4,6,8-tetrapentyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane has a molecular weight of 521.05 g/mol, XLogP of 9.12, 16 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2,4,6,8-tetramethyl-2,4,6,8-tetrapentyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane is sourced from PubChem (CID 142697059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).