1,1,2,2-tetraethoxy-3-ethylidenesilinane

C15H30O4Si — CID 174394025

IUPAC1,1,2,2-tetraethoxy-3-ethylidenesilinane
SMILESCC=C1CCC[Si](OCC)(OCC)C1(OCC)OCC
InChIInChI=1S/C15H30O4Si/c1-6-14-12-11-13-20(18-9-4,19-10-5)15(14,16-7-2)17-8-3/h6H,7-13H2,1-5H3
InChIKeyXQUYVFDJSSCOBK-UHFFFAOYSA-N
MW302.49 g/mol
LogP3.55
Rot. Bonds8

About 1,1,2,2-tetraethoxy-3-ethylidenesilinane

1,1,2,2-tetraethoxy-3-ethylidenesilinane (PubChem CID 174394025) has the molecular formula C15H30O4Si and a molecular weight of 302.49 g/mol. Its IUPAC name is 1,1,2,2-tetraethoxy-3-ethylidenesilinane.

Molecular Properties

Compound Name1,1,2,2-tetraethoxy-3-ethylidenesilinane
PubChem CID174394025
Molecular FormulaC15H30O4Si
Molecular Weight302.49 g/mol
Exact Mass302.19
IUPAC Name1,1,2,2-tetraethoxy-3-ethylidenesilinane
SMILESCC=C1CCC[Si](OCC)(OCC)C1(OCC)OCC
InChIInChI=1S/C15H30O4Si/c1-6-14-12-11-13-20(18-9-4,19-10-5)15(14,16-7-2)17-8-3/h6H,7-13H2,1-5H3
InChIKeyXQUYVFDJSSCOBK-UHFFFAOYSA-N
XLogP3.55
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.49
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1,1,2,2-tetraethoxy-3-ethylidenesilinane?
The IUPAC name of 1,1,2,2-tetraethoxy-3-ethylidenesilinane (CID 174394025) is 1,1,2,2-tetraethoxy-3-ethylidenesilinane.
What is the SMILES notation for 1,1,2,2-tetraethoxy-3-ethylidenesilinane?
The canonical SMILES for 1,1,2,2-tetraethoxy-3-ethylidenesilinane is CC=C1CCC[Si](OCC)(OCC)C1(OCC)OCC.
What is the InChIKey of 1,1,2,2-tetraethoxy-3-ethylidenesilinane?
The InChIKey is XQUYVFDJSSCOBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30O4Si/c1-6-14-12-11-13-20(18-9-4,19-10-5)15(14,16-7-2)17-8-3/h6H,7-13H2,1-5H3.
What are the key properties of 1,1,2,2-tetraethoxy-3-ethylidenesilinane?
1,1,2,2-tetraethoxy-3-ethylidenesilinane has a molecular weight of 302.49 g/mol, XLogP of 3.55, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,2-tetraethoxy-3-ethylidenesilinane is sourced from PubChem (CID 174394025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).