1,3-diethyl-1,3-diphenyl-1,3-disiletane

C18H24Si2 — CID 139686277

IUPAC1,3-diethyl-1,3-diphenyl-1,3-disiletane
SMILESCC[Si]1(c2ccccc2)C[Si](CC)(c2ccccc2)C1
InChIInChI=1S/C18H24Si2/c1-3-19(17-11-7-5-8-12-17)15-20(4-2,16-19)18-13-9-6-10-14-18/h5-14H,3-4,15-16H2,1-2H3
InChIKeyWYEQCIHSKZYPLG-UHFFFAOYSA-N
MW296.56 g/mol
LogP3.83
Rot. Bonds4

About 1,3-diethyl-1,3-diphenyl-1,3-disiletane

1,3-diethyl-1,3-diphenyl-1,3-disiletane (PubChem CID 139686277) has the molecular formula C18H24Si2 and a molecular weight of 296.56 g/mol. Its IUPAC name is 1,3-diethyl-1,3-diphenyl-1,3-disiletane.

Molecular Properties

Compound Name1,3-diethyl-1,3-diphenyl-1,3-disiletane
PubChem CID139686277
Molecular FormulaC18H24Si2
Molecular Weight296.56 g/mol
Exact Mass296.14
IUPAC Name1,3-diethyl-1,3-diphenyl-1,3-disiletane
SMILESCC[Si]1(c2ccccc2)C[Si](CC)(c2ccccc2)C1
InChIInChI=1S/C18H24Si2/c1-3-19(17-11-7-5-8-12-17)15-20(4-2,16-19)18-13-9-6-10-14-18/h5-14H,3-4,15-16H2,1-2H3
InChIKeyWYEQCIHSKZYPLG-UHFFFAOYSA-N
XLogP3.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.56
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 1,3-diethyl-1,3-diphenyl-1,3-disiletane?
The IUPAC name of 1,3-diethyl-1,3-diphenyl-1,3-disiletane (CID 139686277) is 1,3-diethyl-1,3-diphenyl-1,3-disiletane.
What is the SMILES notation for 1,3-diethyl-1,3-diphenyl-1,3-disiletane?
The canonical SMILES for 1,3-diethyl-1,3-diphenyl-1,3-disiletane is CC[Si]1(c2ccccc2)C[Si](CC)(c2ccccc2)C1.
What is the InChIKey of 1,3-diethyl-1,3-diphenyl-1,3-disiletane?
The InChIKey is WYEQCIHSKZYPLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24Si2/c1-3-19(17-11-7-5-8-12-17)15-20(4-2,16-19)18-13-9-6-10-14-18/h5-14H,3-4,15-16H2,1-2H3.
What are the key properties of 1,3-diethyl-1,3-diphenyl-1,3-disiletane?
1,3-diethyl-1,3-diphenyl-1,3-disiletane has a molecular weight of 296.56 g/mol, XLogP of 3.83, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-diethyl-1,3-diphenyl-1,3-disiletane is sourced from PubChem (CID 139686277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).