1,1,3,3,5,5-hexaethoxy-1,3,5-trisilinane

C15H36O6Si3 — CID 10960278

IUPAC1,1,3,3,5,5-hexaethoxy-1,3,5-trisilinane
SMILESCCO[Si]1(OCC)C[Si](OCC)(OCC)C[Si](OCC)(OCC)C1
InChIInChI=1S/C15H36O6Si3/c1-7-16-22(17-8-2)13-23(18-9-3,19-10-4)15-24(14-22,20-11-5)21-12-6/h7-15H2,1-6H3
InChIKeySPEDTQCGQOZHQP-UHFFFAOYSA-N
MW396.71 g/mol
LogP3.16
Rot. Bonds12

About 1,1,3,3,5,5-hexaethoxy-1,3,5-trisilinane

1,1,3,3,5,5-hexaethoxy-1,3,5-trisilinane (PubChem CID 10960278) has the molecular formula C15H36O6Si3 and a molecular weight of 396.71 g/mol. Its IUPAC name is 1,1,3,3,5,5-hexaethoxy-1,3,5-trisilinane.

Molecular Properties

Compound Name1,1,3,3,5,5-hexaethoxy-1,3,5-trisilinane
PubChem CID10960278
Molecular FormulaC15H36O6Si3
Molecular Weight396.71 g/mol
Exact Mass396.18
IUPAC Name1,1,3,3,5,5-hexaethoxy-1,3,5-trisilinane
SMILESCCO[Si]1(OCC)C[Si](OCC)(OCC)C[Si](OCC)(OCC)C1
InChIInChI=1S/C15H36O6Si3/c1-7-16-22(17-8-2)13-23(18-9-3,19-10-4)15-24(14-22,20-11-5)21-12-6/h7-15H2,1-6H3
InChIKeySPEDTQCGQOZHQP-UHFFFAOYSA-N
XLogP3.16
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.71
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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 1,1,3,3,5,5-hexaethoxy-1,3,5-trisilinane?
The IUPAC name of 1,1,3,3,5,5-hexaethoxy-1,3,5-trisilinane (CID 10960278) is 1,1,3,3,5,5-hexaethoxy-1,3,5-trisilinane.
What is the SMILES notation for 1,1,3,3,5,5-hexaethoxy-1,3,5-trisilinane?
The canonical SMILES for 1,1,3,3,5,5-hexaethoxy-1,3,5-trisilinane is CCO[Si]1(OCC)C[Si](OCC)(OCC)C[Si](OCC)(OCC)C1.
What is the InChIKey of 1,1,3,3,5,5-hexaethoxy-1,3,5-trisilinane?
The InChIKey is SPEDTQCGQOZHQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H36O6Si3/c1-7-16-22(17-8-2)13-23(18-9-3,19-10-4)15-24(14-22,20-11-5)21-12-6/h7-15H2,1-6H3.
What are the key properties of 1,1,3,3,5,5-hexaethoxy-1,3,5-trisilinane?
1,1,3,3,5,5-hexaethoxy-1,3,5-trisilinane has a molecular weight of 396.71 g/mol, XLogP of 3.16, 12 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,3,3,5,5-hexaethoxy-1,3,5-trisilinane is sourced from PubChem (CID 10960278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).