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

C12H32O8Si4 — CID 19782812

IUPAC2,2,4,4-tetraethoxy-6,6,8,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
SMILESCCO[Si]1(OCC)O[Si](C)(C)O[Si](C)(C)O[Si](OCC)(OCC)O1
InChIInChI=1S/C12H32O8Si4/c1-9-13-23(14-10-2)18-21(5,6)17-22(7,8)19-24(20-23,15-11-3)16-12-4/h9-12H2,1-8H3
InChIKeyXPQCSPYMDJTLLS-UHFFFAOYSA-N
MW416.72 g/mol
LogP2.49
Rot. Bonds8

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

2,2,4,4-tetraethoxy-6,6,8,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane (PubChem CID 19782812) has the molecular formula C12H32O8Si4 and a molecular weight of 416.72 g/mol. Its IUPAC name is 2,2,4,4-tetraethoxy-6,6,8,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane.

Molecular Properties

Compound Name2,2,4,4-tetraethoxy-6,6,8,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
PubChem CID19782812
Molecular FormulaC12H32O8Si4
Molecular Weight416.72 g/mol
Exact Mass416.12
IUPAC Name2,2,4,4-tetraethoxy-6,6,8,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
SMILESCCO[Si]1(OCC)O[Si](C)(C)O[Si](C)(C)O[Si](OCC)(OCC)O1
InChIInChI=1S/C12H32O8Si4/c1-9-13-23(14-10-2)18-21(5,6)17-22(7,8)19-24(20-23,15-11-3)16-12-4/h9-12H2,1-8H3
InChIKeyXPQCSPYMDJTLLS-UHFFFAOYSA-N
XLogP2.49
TPSA73.84 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.72
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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-tetraethoxy-6,6,8,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane?
The IUPAC name of 2,2,4,4-tetraethoxy-6,6,8,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane (CID 19782812) is 2,2,4,4-tetraethoxy-6,6,8,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane.
What is the SMILES notation for 2,2,4,4-tetraethoxy-6,6,8,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane?
The canonical SMILES for 2,2,4,4-tetraethoxy-6,6,8,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane is CCO[Si]1(OCC)O[Si](C)(C)O[Si](C)(C)O[Si](OCC)(OCC)O1.
What is the InChIKey of 2,2,4,4-tetraethoxy-6,6,8,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane?
The InChIKey is XPQCSPYMDJTLLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H32O8Si4/c1-9-13-23(14-10-2)18-21(5,6)17-22(7,8)19-24(20-23,15-11-3)16-12-4/h9-12H2,1-8H3.
What are the key properties of 2,2,4,4-tetraethoxy-6,6,8,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane?
2,2,4,4-tetraethoxy-6,6,8,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane has a molecular weight of 416.72 g/mol, XLogP of 2.49, 8 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,4,4-tetraethoxy-6,6,8,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane is sourced from PubChem (CID 19782812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).