[dimethyl(3-trimethoxysilylpropyl)silyl]oxy-(11-ethylperoxyundecyl)-dimethoxysilane

C23H54O8Si3 — CID 170541717

IUPAC[dimethyl(3-trimethoxysilylpropyl)silyl]oxy-(11-ethylperoxyundecyl)-dimethoxysilane
SMILESCCOOCCCCCCCCCCC[Si](OC)(OC)O[Si](C)(C)CCC[Si](OC)(OC)OC
InChIInChI=1S/C23H54O8Si3/c1-9-29-30-20-17-15-13-11-10-12-14-16-18-22-34(27-5,28-6)31-32(7,8)21-19-23-33(24-2,25-3)26-4/h9-23H2,1-8H3
InChIKeySINJKHOTXJDLLP-UHFFFAOYSA-N
MW542.94 g/mol
LogP6.19
Rot. Bonds25

About [dimethyl(3-trimethoxysilylpropyl)silyl]oxy-(11-ethylperoxyundecyl)-dimethoxysilane

[dimethyl(3-trimethoxysilylpropyl)silyl]oxy-(11-ethylperoxyundecyl)-dimethoxysilane (PubChem CID 170541717) has the molecular formula C23H54O8Si3 and a molecular weight of 542.94 g/mol. Its IUPAC name is [dimethyl(3-trimethoxysilylpropyl)silyl]oxy-(11-ethylperoxyundecyl)-dimethoxysilane.

Molecular Properties

Compound Name[dimethyl(3-trimethoxysilylpropyl)silyl]oxy-(11-ethylperoxyundecyl)-dimethoxysilane
PubChem CID170541717
Molecular FormulaC23H54O8Si3
Molecular Weight542.94 g/mol
Exact Mass542.31
IUPAC Name[dimethyl(3-trimethoxysilylpropyl)silyl]oxy-(11-ethylperoxyundecyl)-dimethoxysilane
SMILESCCOOCCCCCCCCCCC[Si](OC)(OC)O[Si](C)(C)CCC[Si](OC)(OC)OC
InChIInChI=1S/C23H54O8Si3/c1-9-29-30-20-17-15-13-11-10-12-14-16-18-22-34(27-5,28-6)31-32(7,8)21-19-23-33(24-2,25-3)26-4/h9-23H2,1-8H3
InChIKeySINJKHOTXJDLLP-UHFFFAOYSA-N
XLogP6.19
TPSA73.84 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds25
Heavy Atoms34
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500542.94
LogP ≤ 56.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

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Related Compounds

tris[[dimethyl(3-trimethoxysilylpropyl)silyl]oxy]-(5-ethylperoxypentyl)silane
CID 170541723
11-ethylperoxyundecyl(trimethoxy)silane
CID 155643912
tris[[dimethyl(8-trimethoxysilyloctyl)silyl]oxy]-[3-[[4-[11-ethylperoxyundecyl(dimethyl)silyl]phenyl]-dimethylsilyl]propyl]silane
CID 155643898
tris[[dimethyl(3-trimethoxysilylpropyl)silyl]oxy]-[3-[[4-[11-ethylperoxyundecyl(dimethyl)silyl]phenyl]-dimethylsilyl]propyl]silane
CID 155643967
[4-[dimethyl(3-trimethoxysilylpropyl)silyl]phenyl]-(11-ethylperoxyundecyl)-dimethylsilane
CID 155643997
trimethoxy(11-methylperoxyundecyl)silane
CID 155643983
[dimethyl(2-trimethoxysilylethyl)silyl]oxy-dodecyl-dimethylsilane
CID 59027325
butyl-[dimethyl(2-trimethoxysilylethyl)silyl]oxy-dimethylsilane
CID 59431043
trimethoxy(6-trimethoxysilylhexyl)silane
CID 158013726
[dimethoxy(octyl)silyl]oxy-[dodecyl(dimethoxy)silyl]oxy-methoxy-octylsilane
CID 168727663
dimethoxy-(4-triethoxysilylbutoxy)-(3-triethoxysilylpropyl)silane
CID 175038998
trimethoxy-[11-(2-methoxyethoxy)undecyl]silane
CID 88574364

Frequently Asked Questions

What is the IUPAC name of [dimethyl(3-trimethoxysilylpropyl)silyl]oxy-(11-ethylperoxyundecyl)-dimethoxysilane?
The IUPAC name of [dimethyl(3-trimethoxysilylpropyl)silyl]oxy-(11-ethylperoxyundecyl)-dimethoxysilane (CID 170541717) is [dimethyl(3-trimethoxysilylpropyl)silyl]oxy-(11-ethylperoxyundecyl)-dimethoxysilane.
What is the SMILES notation for [dimethyl(3-trimethoxysilylpropyl)silyl]oxy-(11-ethylperoxyundecyl)-dimethoxysilane?
The canonical SMILES for [dimethyl(3-trimethoxysilylpropyl)silyl]oxy-(11-ethylperoxyundecyl)-dimethoxysilane is CCOOCCCCCCCCCCC[Si](OC)(OC)O[Si](C)(C)CCC[Si](OC)(OC)OC.
What is the InChIKey of [dimethyl(3-trimethoxysilylpropyl)silyl]oxy-(11-ethylperoxyundecyl)-dimethoxysilane?
The InChIKey is SINJKHOTXJDLLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H54O8Si3/c1-9-29-30-20-17-15-13-11-10-12-14-16-18-22-34(27-5,28-6)31-32(7,8)21-19-23-33(24-2,25-3)26-4/h9-23H2,1-8H3.
What are the key properties of [dimethyl(3-trimethoxysilylpropyl)silyl]oxy-(11-ethylperoxyundecyl)-dimethoxysilane?
[dimethyl(3-trimethoxysilylpropyl)silyl]oxy-(11-ethylperoxyundecyl)-dimethoxysilane has a molecular weight of 542.94 g/mol, XLogP of 6.19, 25 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [dimethyl(3-trimethoxysilylpropyl)silyl]oxy-(11-ethylperoxyundecyl)-dimethoxysilane is sourced from PubChem (CID 170541717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).