dodecoxy-ethenyl-(ethenyl-methyl-propoxysilyl)oxy-methylsilane

C21H44O3Si2 — CID 91726655

IUPACdodecoxy-ethenyl-(ethenyl-methyl-propoxysilyl)oxy-methylsilane
SMILESC=C[Si](C)(OCCC)O[Si](C)(C=C)OCCCCCCCCCCCC
InChIInChI=1S/C21H44O3Si2/c1-7-11-12-13-14-15-16-17-18-19-21-23-26(6,10-4)24-25(5,9-3)22-20-8-2/h9-10H,3-4,7-8,11-21H2,1-2,5-6H3
InChIKeyCUWYZIOLFWBHKJ-UHFFFAOYSA-N
MW400.75 g/mol
LogP6.96
Rot. Bonds19

About dodecoxy-ethenyl-(ethenyl-methyl-propoxysilyl)oxy-methylsilane

dodecoxy-ethenyl-(ethenyl-methyl-propoxysilyl)oxy-methylsilane (PubChem CID 91726655) has the molecular formula C21H44O3Si2 and a molecular weight of 400.75 g/mol. Its IUPAC name is dodecoxy-ethenyl-(ethenyl-methyl-propoxysilyl)oxy-methylsilane.

Molecular Properties

Compound Namedodecoxy-ethenyl-(ethenyl-methyl-propoxysilyl)oxy-methylsilane
PubChem CID91726655
Molecular FormulaC21H44O3Si2
Molecular Weight400.75 g/mol
Exact Mass400.28
IUPAC Namedodecoxy-ethenyl-(ethenyl-methyl-propoxysilyl)oxy-methylsilane
SMILESC=C[Si](C)(OCCC)O[Si](C)(C=C)OCCCCCCCCCCCC
InChIInChI=1S/C21H44O3Si2/c1-7-11-12-13-14-15-16-17-18-19-21-23-26(6,10-4)24-25(5,9-3)22-20-8-2/h9-10H,3-4,7-8,11-21H2,1-2,5-6H3
InChIKeyCUWYZIOLFWBHKJ-UHFFFAOYSA-N
XLogP6.96
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds19
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500400.75
LogP ≤ 56.96
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

3-(3-((8-Methoxyoctyl)oxy)propyl)-1,1,1,3,5,5,5-heptamethyltrisiloxane
CID 60196421
Silane, dimethyloctyloxyoctyloxy-
CID 14228745
Silane, dimethyldecyloxydecyloxy-
CID 23342514
1-Triethylsilyloxydecane
CID 523468
1-Tripropylsilyloxytetradecane
CID 523478
1,10-decanediol, tBDMS
CID 6430197
1-Octadecanol, triethylsilyl ether
CID 523472
1,8-octanediol, tBDMS
CID 6430203
1-Triethylsilyloxyheptadecane
CID 631085
1-(Trihexylsilyloxy)octane
CID 533029
bis(Dodecyloxy)(dimethyl)silane
CID 20716717
Silane, methylvinyl(octyloxy)octyloxy-
CID 23105081

Frequently Asked Questions

What is the IUPAC name of dodecoxy-ethenyl-(ethenyl-methyl-propoxysilyl)oxy-methylsilane?
The IUPAC name of dodecoxy-ethenyl-(ethenyl-methyl-propoxysilyl)oxy-methylsilane (CID 91726655) is dodecoxy-ethenyl-(ethenyl-methyl-propoxysilyl)oxy-methylsilane.
What is the SMILES notation for dodecoxy-ethenyl-(ethenyl-methyl-propoxysilyl)oxy-methylsilane?
The canonical SMILES for dodecoxy-ethenyl-(ethenyl-methyl-propoxysilyl)oxy-methylsilane is C=C[Si](C)(OCCC)O[Si](C)(C=C)OCCCCCCCCCCCC.
What is the InChIKey of dodecoxy-ethenyl-(ethenyl-methyl-propoxysilyl)oxy-methylsilane?
The InChIKey is CUWYZIOLFWBHKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H44O3Si2/c1-7-11-12-13-14-15-16-17-18-19-21-23-26(6,10-4)24-25(5,9-3)22-20-8-2/h9-10H,3-4,7-8,11-21H2,1-2,5-6H3.
What are the key properties of dodecoxy-ethenyl-(ethenyl-methyl-propoxysilyl)oxy-methylsilane?
dodecoxy-ethenyl-(ethenyl-methyl-propoxysilyl)oxy-methylsilane has a molecular weight of 400.75 g/mol, XLogP of 6.96, 19 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dodecoxy-ethenyl-(ethenyl-methyl-propoxysilyl)oxy-methylsilane is sourced from PubChem (CID 91726655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).