ethenyl-(ethenyl-heptan-4-yloxy-methylsilyl)oxy-heptan-4-yloxy-methylsilane

C20H42O3Si2 — CID 91726528

IUPACethenyl-(ethenyl-heptan-4-yloxy-methylsilyl)oxy-heptan-4-yloxy-methylsilane
SMILESC=C[Si](C)(OC(CCC)CCC)O[Si](C)(C=C)OC(CCC)CCC
InChIInChI=1S/C20H42O3Si2/c1-9-15-19(16-10-2)21-24(7,13-5)23-25(8,14-6)22-20(17-11-3)18-12-4/h13-14,19-20H,5-6,9-12,15-18H2,1-4,7-8H3
InChIKeyGSSNCNXEVGZZOG-UHFFFAOYSA-N
MW386.73 g/mol
LogP6.57
Rot. Bonds16

About ethenyl-(ethenyl-heptan-4-yloxy-methylsilyl)oxy-heptan-4-yloxy-methylsilane

ethenyl-(ethenyl-heptan-4-yloxy-methylsilyl)oxy-heptan-4-yloxy-methylsilane (PubChem CID 91726528) has the molecular formula C20H42O3Si2 and a molecular weight of 386.73 g/mol. Its IUPAC name is ethenyl-(ethenyl-heptan-4-yloxy-methylsilyl)oxy-heptan-4-yloxy-methylsilane.

Molecular Properties

Compound Nameethenyl-(ethenyl-heptan-4-yloxy-methylsilyl)oxy-heptan-4-yloxy-methylsilane
PubChem CID91726528
Molecular FormulaC20H42O3Si2
Molecular Weight386.73 g/mol
Exact Mass386.27
IUPAC Nameethenyl-(ethenyl-heptan-4-yloxy-methylsilyl)oxy-heptan-4-yloxy-methylsilane
SMILESC=C[Si](C)(OC(CCC)CCC)O[Si](C)(C=C)OC(CCC)CCC
InChIInChI=1S/C20H42O3Si2/c1-9-15-19(16-10-2)21-24(7,13-5)23-25(8,14-6)22-20(17-11-3)18-12-4/h13-14,19-20H,5-6,9-12,15-18H2,1-4,7-8H3
InChIKeyGSSNCNXEVGZZOG-UHFFFAOYSA-N
XLogP6.57
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds16
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.73
LogP ≤ 56.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 ethenyl-(ethenyl-heptan-4-yloxy-methylsilyl)oxy-heptan-4-yloxy-methylsilane?
The IUPAC name of ethenyl-(ethenyl-heptan-4-yloxy-methylsilyl)oxy-heptan-4-yloxy-methylsilane (CID 91726528) is ethenyl-(ethenyl-heptan-4-yloxy-methylsilyl)oxy-heptan-4-yloxy-methylsilane.
What is the SMILES notation for ethenyl-(ethenyl-heptan-4-yloxy-methylsilyl)oxy-heptan-4-yloxy-methylsilane?
The canonical SMILES for ethenyl-(ethenyl-heptan-4-yloxy-methylsilyl)oxy-heptan-4-yloxy-methylsilane is C=C[Si](C)(OC(CCC)CCC)O[Si](C)(C=C)OC(CCC)CCC.
What is the InChIKey of ethenyl-(ethenyl-heptan-4-yloxy-methylsilyl)oxy-heptan-4-yloxy-methylsilane?
The InChIKey is GSSNCNXEVGZZOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H42O3Si2/c1-9-15-19(16-10-2)21-24(7,13-5)23-25(8,14-6)22-20(17-11-3)18-12-4/h13-14,19-20H,5-6,9-12,15-18H2,1-4,7-8H3.
What are the key properties of ethenyl-(ethenyl-heptan-4-yloxy-methylsilyl)oxy-heptan-4-yloxy-methylsilane?
ethenyl-(ethenyl-heptan-4-yloxy-methylsilyl)oxy-heptan-4-yloxy-methylsilane has a molecular weight of 386.73 g/mol, XLogP of 6.57, 16 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl-(ethenyl-heptan-4-yloxy-methylsilyl)oxy-heptan-4-yloxy-methylsilane is sourced from PubChem (CID 91726528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).