triethyl(12-triethylsilyldodeca-1,3,5,7,9,11-hexaynyl)silane

C24H30Si2 — CID 134885307

IUPACtriethyl(12-triethylsilyldodeca-1,3,5,7,9,11-hexaynyl)silane
SMILESCC[Si](C#CC#CC#CC#CC#CC#C[Si](CC)(CC)CC)(CC)CC
InChIInChI=1S/C24H30Si2/c1-7-25(8-2,9-3)23-21-19-17-15-13-14-16-18-20-22-24-26(10-4,11-5)12-6/h7-12H2,1-6H3
InChIKeyKOHYDPKYDLKGRD-UHFFFAOYSA-N
MW374.68 g/mol
LogP5.10
Rot. Bonds6

About triethyl(12-triethylsilyldodeca-1,3,5,7,9,11-hexaynyl)silane

triethyl(12-triethylsilyldodeca-1,3,5,7,9,11-hexaynyl)silane (PubChem CID 134885307) has the molecular formula C24H30Si2 and a molecular weight of 374.68 g/mol. Its IUPAC name is triethyl(12-triethylsilyldodeca-1,3,5,7,9,11-hexaynyl)silane.

Molecular Properties

Compound Nametriethyl(12-triethylsilyldodeca-1,3,5,7,9,11-hexaynyl)silane
PubChem CID134885307
Molecular FormulaC24H30Si2
Molecular Weight374.68 g/mol
Exact Mass374.19
IUPAC Nametriethyl(12-triethylsilyldodeca-1,3,5,7,9,11-hexaynyl)silane
SMILESCC[Si](C#CC#CC#CC#CC#CC#C[Si](CC)(CC)CC)(CC)CC
InChIInChI=1S/C24H30Si2/c1-7-25(8-2,9-3)23-21-19-17-15-13-14-16-18-20-22-24-26(10-4,11-5)12-6/h7-12H2,1-6H3
InChIKeyKOHYDPKYDLKGRD-UHFFFAOYSA-N
XLogP5.10
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.68
LogP ≤ 55.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of triethyl(12-triethylsilyldodeca-1,3,5,7,9,11-hexaynyl)silane?
The IUPAC name of triethyl(12-triethylsilyldodeca-1,3,5,7,9,11-hexaynyl)silane (CID 134885307) is triethyl(12-triethylsilyldodeca-1,3,5,7,9,11-hexaynyl)silane.
What is the SMILES notation for triethyl(12-triethylsilyldodeca-1,3,5,7,9,11-hexaynyl)silane?
The canonical SMILES for triethyl(12-triethylsilyldodeca-1,3,5,7,9,11-hexaynyl)silane is CC[Si](C#CC#CC#CC#CC#CC#C[Si](CC)(CC)CC)(CC)CC.
What is the InChIKey of triethyl(12-triethylsilyldodeca-1,3,5,7,9,11-hexaynyl)silane?
The InChIKey is KOHYDPKYDLKGRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30Si2/c1-7-25(8-2,9-3)23-21-19-17-15-13-14-16-18-20-22-24-26(10-4,11-5)12-6/h7-12H2,1-6H3.
What are the key properties of triethyl(12-triethylsilyldodeca-1,3,5,7,9,11-hexaynyl)silane?
triethyl(12-triethylsilyldodeca-1,3,5,7,9,11-hexaynyl)silane has a molecular weight of 374.68 g/mol, XLogP of 5.10, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl(12-triethylsilyldodeca-1,3,5,7,9,11-hexaynyl)silane is sourced from PubChem (CID 134885307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).