ethene;[(ethenyl-methyl-prop-2-enoxysilyl)oxy-methyl-(methyl-octyl-prop-2-enoxysilyl)oxysilyl]methyl 2-methylprop-2-enoate

C26H50O6Si3 — CID 90911170

IUPACethene;[(ethenyl-methyl-prop-2-enoxysilyl)oxy-methyl-(methyl-octyl-prop-2-enoxysilyl)oxysilyl]methyl 2-methylprop-2-enoate
SMILESC=C.C=CCO[Si](C)(C=C)O[Si](C)(COC(=O)C(=C)C)O[Si](C)(CCCCCCCC)OCC=C
InChIInChI=1S/C24H46O6Si3.C2H4/c1-10-14-15-16-17-18-21-32(8,28-20-12-3)30-33(9,22-26-24(25)23(5)6)29-31(7,13-4)27-19-11-2;1-2/h11-13H,2-5,10,14-22H2,1,6-9H3;1-2H2
InChIKeyLIYSNSGOYBMQCO-UHFFFAOYSA-N
MW542.94 g/mol
LogP7.19
Rot. Bonds21

About ethene;[(ethenyl-methyl-prop-2-enoxysilyl)oxy-methyl-(methyl-octyl-prop-2-enoxysilyl)oxysilyl]methyl 2-methylprop-2-enoate

ethene;[(ethenyl-methyl-prop-2-enoxysilyl)oxy-methyl-(methyl-octyl-prop-2-enoxysilyl)oxysilyl]methyl 2-methylprop-2-enoate (PubChem CID 90911170) has the molecular formula C26H50O6Si3 and a molecular weight of 542.94 g/mol. Its IUPAC name is ethene;[(ethenyl-methyl-prop-2-enoxysilyl)oxy-methyl-(methyl-octyl-prop-2-enoxysilyl)oxysilyl]methyl 2-methylprop-2-enoate.

Molecular Properties

Compound Nameethene;[(ethenyl-methyl-prop-2-enoxysilyl)oxy-methyl-(methyl-octyl-prop-2-enoxysilyl)oxysilyl]methyl 2-methylprop-2-enoate
PubChem CID90911170
Molecular FormulaC26H50O6Si3
Molecular Weight542.94 g/mol
Exact Mass542.29
IUPAC Nameethene;[(ethenyl-methyl-prop-2-enoxysilyl)oxy-methyl-(methyl-octyl-prop-2-enoxysilyl)oxysilyl]methyl 2-methylprop-2-enoate
SMILESC=C.C=CCO[Si](C)(C=C)O[Si](C)(COC(=O)C(=C)C)O[Si](C)(CCCCCCCC)OCC=C
InChIInChI=1S/C24H46O6Si3.C2H4/c1-10-14-15-16-17-18-21-32(8,28-20-12-3)30-33(9,22-26-24(25)23(5)6)29-31(7,13-4)27-19-11-2;1-2/h11-13H,2-5,10,14-22H2,1,6-9H3;1-2H2
InChIKeyLIYSNSGOYBMQCO-UHFFFAOYSA-N
XLogP7.19
TPSA63.22 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds21
Heavy Atoms35
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500542.94
LogP ≤ 57.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

ethenyl-[ethenyl-methyl-(methyl-prop-2-enoxy-propylsilyl)oxysilyl]oxy-methyl-prop-2-enoxysilane
CID 21339181
11-[dihexoxy(methyl)silyl]undecyl 2-methylprop-2-enoate
CID 142567348
[dibutoxy(methyl)silyl]methyl 2-methylprop-2-enoate;3-[dimethoxy(methyl)silyl]propyl prop-2-enoate
CID 88604956
3-[diethoxy(methyl)silyl]propyl 2-methylprop-2-enoate;tetraethyl silicate
CID 87080022
2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate;tridecane
CID 87383190
[methyl-bis(trimethylsilyloxy)silyl]methyl 2-methylprop-2-enoate;bis(3-[methyl-bis(trimethylsilyloxy)silyl]propyl 2-methylprop-2-enoate);trimethylsilylmethyl 2-methylprop-2-enoate;trimethylsilyl 2-methylprop-2-enoate
CID 160730150
3-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]propyl 2-methylprop-2-enoate
CID 22094222
2-[bis[2-(2-methylprop-2-enoyloxy)ethoxy]-pentylsilyl]oxyethyl 2-methylprop-2-enoate
CID 101194851
2-[2-(3-trihexylsilylpropoxy)ethoxy]ethyl 2-methylprop-2-enoate
CID 123411078
tris[[ethenyl(dimethyl)silyl]oxy]silylmethyl 2-methylprop-2-enoate
CID 87101348
decyl 2-methylprop-2-enoate;dodecyl 2-methylprop-2-enoate;hexadecyl 2-methylprop-2-enoate;pentadecyl 2-methylprop-2-enoate;tetradecyl 2-methylprop-2-enoate;tridecyl 2-methylprop-2-enoate;undecyl 2-methylprop-2-enoate
CID 164995054
octatetracontyl 2-methylprop-2-enoate
CID 141233444

Frequently Asked Questions

What is the IUPAC name of ethene;[(ethenyl-methyl-prop-2-enoxysilyl)oxy-methyl-(methyl-octyl-prop-2-enoxysilyl)oxysilyl]methyl 2-methylprop-2-enoate?
The IUPAC name of ethene;[(ethenyl-methyl-prop-2-enoxysilyl)oxy-methyl-(methyl-octyl-prop-2-enoxysilyl)oxysilyl]methyl 2-methylprop-2-enoate (CID 90911170) is ethene;[(ethenyl-methyl-prop-2-enoxysilyl)oxy-methyl-(methyl-octyl-prop-2-enoxysilyl)oxysilyl]methyl 2-methylprop-2-enoate.
What is the SMILES notation for ethene;[(ethenyl-methyl-prop-2-enoxysilyl)oxy-methyl-(methyl-octyl-prop-2-enoxysilyl)oxysilyl]methyl 2-methylprop-2-enoate?
The canonical SMILES for ethene;[(ethenyl-methyl-prop-2-enoxysilyl)oxy-methyl-(methyl-octyl-prop-2-enoxysilyl)oxysilyl]methyl 2-methylprop-2-enoate is C=C.C=CCO[Si](C)(C=C)O[Si](C)(COC(=O)C(=C)C)O[Si](C)(CCCCCCCC)OCC=C.
What is the InChIKey of ethene;[(ethenyl-methyl-prop-2-enoxysilyl)oxy-methyl-(methyl-octyl-prop-2-enoxysilyl)oxysilyl]methyl 2-methylprop-2-enoate?
The InChIKey is LIYSNSGOYBMQCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H46O6Si3.C2H4/c1-10-14-15-16-17-18-21-32(8,28-20-12-3)30-33(9,22-26-24(25)23(5)6)29-31(7,13-4)27-19-11-2;1-2/h11-13H,2-5,10,14-22H2,1,6-9H3;1-2H2.
What are the key properties of ethene;[(ethenyl-methyl-prop-2-enoxysilyl)oxy-methyl-(methyl-octyl-prop-2-enoxysilyl)oxysilyl]methyl 2-methylprop-2-enoate?
ethene;[(ethenyl-methyl-prop-2-enoxysilyl)oxy-methyl-(methyl-octyl-prop-2-enoxysilyl)oxysilyl]methyl 2-methylprop-2-enoate has a molecular weight of 542.94 g/mol, XLogP of 7.19, 21 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;[(ethenyl-methyl-prop-2-enoxysilyl)oxy-methyl-(methyl-octyl-prop-2-enoxysilyl)oxysilyl]methyl 2-methylprop-2-enoate is sourced from PubChem (CID 90911170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).