ethenyl-[ethenyl-methyl-(2-methylpropoxy)silyl]oxy-methyl-undecoxysilane

C21H44O3Si2 — CID 91726659

IUPACethenyl-[ethenyl-methyl-(2-methylpropoxy)silyl]oxy-methyl-undecoxysilane
SMILESC=C[Si](C)(OCCCCCCCCCCC)O[Si](C)(C=C)OCC(C)C
InChIInChI=1S/C21H44O3Si2/c1-8-11-12-13-14-15-16-17-18-19-22-25(6,9-2)24-26(7,10-3)23-20-21(4)5/h9-10,21H,2-3,8,11-20H2,1,4-7H3
InChIKeyYMJFVUXZLFPBJP-UHFFFAOYSA-N
MW400.75 g/mol
LogP6.82
Rot. Bonds18

About ethenyl-[ethenyl-methyl-(2-methylpropoxy)silyl]oxy-methyl-undecoxysilane

ethenyl-[ethenyl-methyl-(2-methylpropoxy)silyl]oxy-methyl-undecoxysilane (PubChem CID 91726659) has the molecular formula C21H44O3Si2 and a molecular weight of 400.75 g/mol. Its IUPAC name is ethenyl-[ethenyl-methyl-(2-methylpropoxy)silyl]oxy-methyl-undecoxysilane.

Molecular Properties

Compound Nameethenyl-[ethenyl-methyl-(2-methylpropoxy)silyl]oxy-methyl-undecoxysilane
PubChem CID91726659
Molecular FormulaC21H44O3Si2
Molecular Weight400.75 g/mol
Exact Mass400.28
IUPAC Nameethenyl-[ethenyl-methyl-(2-methylpropoxy)silyl]oxy-methyl-undecoxysilane
SMILESC=C[Si](C)(OCCCCCCCCCCC)O[Si](C)(C=C)OCC(C)C
InChIInChI=1S/C21H44O3Si2/c1-8-11-12-13-14-15-16-17-18-19-22-25(6,9-2)24-26(7,10-3)23-20-21(4)5/h9-10,21H,2-3,8,11-20H2,1,4-7H3
InChIKeyYMJFVUXZLFPBJP-UHFFFAOYSA-N
XLogP6.82
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds18
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500400.75
LogP ≤ 56.82
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-methyl-(2-methylpropoxy)silyl]oxy-methyl-undecoxysilane?
The IUPAC name of ethenyl-[ethenyl-methyl-(2-methylpropoxy)silyl]oxy-methyl-undecoxysilane (CID 91726659) is ethenyl-[ethenyl-methyl-(2-methylpropoxy)silyl]oxy-methyl-undecoxysilane.
What is the SMILES notation for ethenyl-[ethenyl-methyl-(2-methylpropoxy)silyl]oxy-methyl-undecoxysilane?
The canonical SMILES for ethenyl-[ethenyl-methyl-(2-methylpropoxy)silyl]oxy-methyl-undecoxysilane is C=C[Si](C)(OCCCCCCCCCCC)O[Si](C)(C=C)OCC(C)C.
What is the InChIKey of ethenyl-[ethenyl-methyl-(2-methylpropoxy)silyl]oxy-methyl-undecoxysilane?
The InChIKey is YMJFVUXZLFPBJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H44O3Si2/c1-8-11-12-13-14-15-16-17-18-19-22-25(6,9-2)24-26(7,10-3)23-20-21(4)5/h9-10,21H,2-3,8,11-20H2,1,4-7H3.
What are the key properties of ethenyl-[ethenyl-methyl-(2-methylpropoxy)silyl]oxy-methyl-undecoxysilane?
ethenyl-[ethenyl-methyl-(2-methylpropoxy)silyl]oxy-methyl-undecoxysilane has a molecular weight of 400.75 g/mol, XLogP of 6.82, 18 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl-[ethenyl-methyl-(2-methylpropoxy)silyl]oxy-methyl-undecoxysilane is sourced from PubChem (CID 91726659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).