ethenyl-(ethenyl-hexadecoxy-methylsilyl)oxy-methyl-(2-methylpropoxy)silane

C26H54O3Si2 — CID 91726727

IUPACethenyl-(ethenyl-hexadecoxy-methylsilyl)oxy-methyl-(2-methylpropoxy)silane
SMILESC=C[Si](C)(OCCCCCCCCCCCCCCCC)O[Si](C)(C=C)OCC(C)C
InChIInChI=1S/C26H54O3Si2/c1-8-11-12-13-14-15-16-17-18-19-20-21-22-23-24-27-30(6,9-2)29-31(7,10-3)28-25-26(4)5/h9-10,26H,2-3,8,11-25H2,1,4-7H3
InChIKeyKIDHCHVYWUHHGQ-UHFFFAOYSA-N
MW470.89 g/mol
LogP8.77
Rot. Bonds23

About ethenyl-(ethenyl-hexadecoxy-methylsilyl)oxy-methyl-(2-methylpropoxy)silane

ethenyl-(ethenyl-hexadecoxy-methylsilyl)oxy-methyl-(2-methylpropoxy)silane (PubChem CID 91726727) has the molecular formula C26H54O3Si2 and a molecular weight of 470.89 g/mol. Its IUPAC name is ethenyl-(ethenyl-hexadecoxy-methylsilyl)oxy-methyl-(2-methylpropoxy)silane.

Molecular Properties

Compound Nameethenyl-(ethenyl-hexadecoxy-methylsilyl)oxy-methyl-(2-methylpropoxy)silane
PubChem CID91726727
Molecular FormulaC26H54O3Si2
Molecular Weight470.89 g/mol
Exact Mass470.36
IUPAC Nameethenyl-(ethenyl-hexadecoxy-methylsilyl)oxy-methyl-(2-methylpropoxy)silane
SMILESC=C[Si](C)(OCCCCCCCCCCCCCCCC)O[Si](C)(C=C)OCC(C)C
InChIInChI=1S/C26H54O3Si2/c1-8-11-12-13-14-15-16-17-18-19-20-21-22-23-24-27-30(6,9-2)29-31(7,10-3)28-25-26(4)5/h9-10,26H,2-3,8,11-25H2,1,4-7H3
InChIKeyKIDHCHVYWUHHGQ-UHFFFAOYSA-N
XLogP8.77
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds23
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500470.89
LogP ≤ 58.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1,10-decanediol, tBDMS
CID 6430197
1,8-octanediol, tBDMS
CID 6430203
Silane, methylvinyl(octyloxy)octyloxy-
CID 23105081
Silane, methylvinyldi(2-ethylhexyloxy)-
CID 23213487
Silane, methylvinyl(dodecyloxy)dodecyloxy-
CID 87770809
1,7-heptanediol, tBDMS
CID 6427123
Silane, methylvinyl(2,4,4-trimethylpentyloxy)tetradecyloxy-
CID 91693701
Silane, methylvinyl(2,4,4-trimethylpentyloxy)pentadecyloxy-
CID 91693706
Silane, methylvinyl(2,4,4-trimethylpentyloxy)hexadecyloxy-
CID 91693712
Silane, methylvinyldi(3,7-dimethyloctyloxy)-
CID 91698190
Silane, methylvinyl(3,7-dimethyloctyloxy)isobutoxy-
CID 91698410
Silane, methylvinyl(3,7-dimethyloctyloxy)butoxy-
CID 91698411

Frequently Asked Questions

What is the IUPAC name of ethenyl-(ethenyl-hexadecoxy-methylsilyl)oxy-methyl-(2-methylpropoxy)silane?
The IUPAC name of ethenyl-(ethenyl-hexadecoxy-methylsilyl)oxy-methyl-(2-methylpropoxy)silane (CID 91726727) is ethenyl-(ethenyl-hexadecoxy-methylsilyl)oxy-methyl-(2-methylpropoxy)silane.
What is the SMILES notation for ethenyl-(ethenyl-hexadecoxy-methylsilyl)oxy-methyl-(2-methylpropoxy)silane?
The canonical SMILES for ethenyl-(ethenyl-hexadecoxy-methylsilyl)oxy-methyl-(2-methylpropoxy)silane is C=C[Si](C)(OCCCCCCCCCCCCCCCC)O[Si](C)(C=C)OCC(C)C.
What is the InChIKey of ethenyl-(ethenyl-hexadecoxy-methylsilyl)oxy-methyl-(2-methylpropoxy)silane?
The InChIKey is KIDHCHVYWUHHGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H54O3Si2/c1-8-11-12-13-14-15-16-17-18-19-20-21-22-23-24-27-30(6,9-2)29-31(7,10-3)28-25-26(4)5/h9-10,26H,2-3,8,11-25H2,1,4-7H3.
What are the key properties of ethenyl-(ethenyl-hexadecoxy-methylsilyl)oxy-methyl-(2-methylpropoxy)silane?
ethenyl-(ethenyl-hexadecoxy-methylsilyl)oxy-methyl-(2-methylpropoxy)silane has a molecular weight of 470.89 g/mol, XLogP of 8.77, 23 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl-(ethenyl-hexadecoxy-methylsilyl)oxy-methyl-(2-methylpropoxy)silane is sourced from PubChem (CID 91726727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).