ethenyl-methyl-octan-4-yloxy-tridecoxysilane

C24H50O2Si — CID 91743291

IUPACethenyl-methyl-octan-4-yloxy-tridecoxysilane
SMILESC=C[Si](C)(OCCCCCCCCCCCCC)OC(CCC)CCCC
InChIInChI=1S/C24H50O2Si/c1-6-10-12-13-14-15-16-17-18-19-20-23-25-27(5,9-4)26-24(21-8-3)22-11-7-2/h9,24H,4,6-8,10-23H2,1-3,5H3
InChIKeyYLGLYFRTOHWRCG-UHFFFAOYSA-N
MW398.75 g/mol
LogP8.49
Rot. Bonds21

About ethenyl-methyl-octan-4-yloxy-tridecoxysilane

ethenyl-methyl-octan-4-yloxy-tridecoxysilane (PubChem CID 91743291) has the molecular formula C24H50O2Si and a molecular weight of 398.75 g/mol. Its IUPAC name is ethenyl-methyl-octan-4-yloxy-tridecoxysilane.

Molecular Properties

Compound Nameethenyl-methyl-octan-4-yloxy-tridecoxysilane
PubChem CID91743291
Molecular FormulaC24H50O2Si
Molecular Weight398.75 g/mol
Exact Mass398.36
IUPAC Nameethenyl-methyl-octan-4-yloxy-tridecoxysilane
SMILESC=C[Si](C)(OCCCCCCCCCCCCC)OC(CCC)CCCC
InChIInChI=1S/C24H50O2Si/c1-6-10-12-13-14-15-16-17-18-19-20-23-25-27(5,9-4)26-24(21-8-3)22-11-7-2/h9,24H,4,6-8,10-23H2,1-3,5H3
InChIKeyYLGLYFRTOHWRCG-UHFFFAOYSA-N
XLogP8.49
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds21
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500398.75
LogP ≤ 58.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

ethenyl-(ethenyl-heptoxy-methylsilyl)oxy-methyl-octan-4-yloxysilane
CID 91740164
ethenyl-heptan-3-yloxy-methyl-tetradecoxysilane
CID 91743295
ethenyl-heptadecoxy-heptan-3-yloxy-methylsilane
CID 91744420
ethenyl-methyl-octan-4-yloxy-propoxysilane
CID 91733090
ethenyl-methyl-pentan-2-yloxy-tridecoxysilane
CID 91742131
ethenyl-heptadecoxy-methyl-pentan-2-yloxysilane
CID 91744084
dodecoxy-ethenyl-methyl-pentadecoxysilane
CID 91745623
ethenyl-heptoxy-methyl-tridecoxysilane
CID 91744074
decoxy-ethenyl-methyl-nonoxysilane
CID 91743696
dodecoxy-ethenyl-methyl-undecoxysilane
CID 91744966
ethenyl-heptoxy-hexadecoxy-methylsilane
CID 91744965
ethenyl-heptoxy-methyl-tetradecoxysilane
CID 91744411

Frequently Asked Questions

What is the IUPAC name of ethenyl-methyl-octan-4-yloxy-tridecoxysilane?
The IUPAC name of ethenyl-methyl-octan-4-yloxy-tridecoxysilane (CID 91743291) is ethenyl-methyl-octan-4-yloxy-tridecoxysilane.
What is the SMILES notation for ethenyl-methyl-octan-4-yloxy-tridecoxysilane?
The canonical SMILES for ethenyl-methyl-octan-4-yloxy-tridecoxysilane is C=C[Si](C)(OCCCCCCCCCCCCC)OC(CCC)CCCC.
What is the InChIKey of ethenyl-methyl-octan-4-yloxy-tridecoxysilane?
The InChIKey is YLGLYFRTOHWRCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H50O2Si/c1-6-10-12-13-14-15-16-17-18-19-20-23-25-27(5,9-4)26-24(21-8-3)22-11-7-2/h9,24H,4,6-8,10-23H2,1-3,5H3.
What are the key properties of ethenyl-methyl-octan-4-yloxy-tridecoxysilane?
ethenyl-methyl-octan-4-yloxy-tridecoxysilane has a molecular weight of 398.75 g/mol, XLogP of 8.49, 21 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl-methyl-octan-4-yloxy-tridecoxysilane is sourced from PubChem (CID 91743291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).