2,2,4,4,6,6,8,8-octapropyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane

C24H56O4Si4 — CID 6426577

IUPAC2,2,4,4,6,6,8,8-octapropyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
SMILESCCC[Si]1(CCC)O[Si](CCC)(CCC)O[Si](CCC)(CCC)O[Si](CCC)(CCC)O1
InChIInChI=1S/C24H56O4Si4/c1-9-17-29(18-10-2)25-30(19-11-3,20-12-4)27-32(23-15-7,24-16-8)28-31(26-29,21-13-5)22-14-6/h9-24H2,1-8H3
InChIKeyGBWWAEXHTRGBRN-UHFFFAOYSA-N
MW521.05 g/mol
LogP9.12
Rot. Bonds16

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

2,2,4,4,6,6,8,8-octapropyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane (PubChem CID 6426577) has the molecular formula C24H56O4Si4 and a molecular weight of 521.05 g/mol. Its IUPAC name is 2,2,4,4,6,6,8,8-octapropyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane.

Molecular Properties

Compound Name2,2,4,4,6,6,8,8-octapropyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
PubChem CID6426577
Molecular FormulaC24H56O4Si4
Molecular Weight521.05 g/mol
Exact Mass520.33
IUPAC Name2,2,4,4,6,6,8,8-octapropyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
SMILESCCC[Si]1(CCC)O[Si](CCC)(CCC)O[Si](CCC)(CCC)O[Si](CCC)(CCC)O1
InChIInChI=1S/C24H56O4Si4/c1-9-17-29(18-10-2)25-30(19-11-3,20-12-4)27-32(23-15-7,24-16-8)28-31(26-29,21-13-5)22-14-6/h9-24H2,1-8H3
InChIKeyGBWWAEXHTRGBRN-UHFFFAOYSA-N
XLogP9.12
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds16
Heavy Atoms32
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500521.05
LogP ≤ 59.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,2,4,4,6,6,8,8-octapropyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane?
The IUPAC name of 2,2,4,4,6,6,8,8-octapropyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane (CID 6426577) is 2,2,4,4,6,6,8,8-octapropyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane.
What is the SMILES notation for 2,2,4,4,6,6,8,8-octapropyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane?
The canonical SMILES for 2,2,4,4,6,6,8,8-octapropyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane is CCC[Si]1(CCC)O[Si](CCC)(CCC)O[Si](CCC)(CCC)O[Si](CCC)(CCC)O1.
What is the InChIKey of 2,2,4,4,6,6,8,8-octapropyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane?
The InChIKey is GBWWAEXHTRGBRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H56O4Si4/c1-9-17-29(18-10-2)25-30(19-11-3,20-12-4)27-32(23-15-7,24-16-8)28-31(26-29,21-13-5)22-14-6/h9-24H2,1-8H3.
What are the key properties of 2,2,4,4,6,6,8,8-octapropyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane?
2,2,4,4,6,6,8,8-octapropyl-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 2,2,4,4,6,6,8,8-octapropyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane is sourced from PubChem (CID 6426577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).