trimethoxy(methyl)silane;trimethoxy(phenyl)silane;3-trimethoxysilylpropyl 2-methylprop-2-enoate

C23H46O11Si3 — CID 170852378

IUPACtrimethoxy(methyl)silane;trimethoxy(phenyl)silane;3-trimethoxysilylpropyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCC[Si](OC)(OC)OC.CO[Si](C)(OC)OC.CO[Si](OC)(OC)c1ccccc1
InChIInChI=1S/C10H20O5Si.C9H14O3Si.C4H12O3Si/c1-9(2)10(11)15-7-6-8-16(12-3,13-4)14-5;1-10-13(11-2,12-3)9-7-5-4-6-8-9;1-5-8(4,6-2)7-3/h1,6-8H2,2-5H3;4-8H,1-3H3;1-4H3
InChIKeyABMOJSOPYAJKAN-UHFFFAOYSA-N
MW582.87 g/mol
LogP2.64
Rot. Bonds15

About trimethoxy(methyl)silane;trimethoxy(phenyl)silane;3-trimethoxysilylpropyl 2-methylprop-2-enoate

trimethoxy(methyl)silane;trimethoxy(phenyl)silane;3-trimethoxysilylpropyl 2-methylprop-2-enoate (PubChem CID 170852378) has the molecular formula C23H46O11Si3 and a molecular weight of 582.87 g/mol. Its IUPAC name is trimethoxy(methyl)silane;trimethoxy(phenyl)silane;3-trimethoxysilylpropyl 2-methylprop-2-enoate.

Molecular Properties

Compound Nametrimethoxy(methyl)silane;trimethoxy(phenyl)silane;3-trimethoxysilylpropyl 2-methylprop-2-enoate
PubChem CID170852378
Molecular FormulaC23H46O11Si3
Molecular Weight582.87 g/mol
Exact Mass582.23
IUPAC Nametrimethoxy(methyl)silane;trimethoxy(phenyl)silane;3-trimethoxysilylpropyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCC[Si](OC)(OC)OC.CO[Si](C)(OC)OC.CO[Si](OC)(OC)c1ccccc1
InChIInChI=1S/C10H20O5Si.C9H14O3Si.C4H12O3Si/c1-9(2)10(11)15-7-6-8-16(12-3,13-4)14-5;1-10-13(11-2,12-3)9-7-5-4-6-8-9;1-5-8(4,6-2)7-3/h1,6-8H2,2-5H3;4-8H,1-3H3;1-4H3
InChIKeyABMOJSOPYAJKAN-UHFFFAOYSA-N
XLogP2.64
TPSA109.37 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds15
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500582.87
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Computed Properties (RDKit)

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

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Related Compounds

2-Propenoic acid, 2-methyl-, (dimethylphenylsilyl)methyl ester
CID 22486740
Ethenyl(triethoxy)silane;methyl 2-methylprop-2-enoate;styrene
CID 168330
Butyl 2-methylprop-2-enoate;2-ethylhexyl prop-2-enoate;methyl 2-methylprop-2-enoate;styrene;3-trimethoxysilylpropyl 2-methylprop-2-enoate
CID 170852389
Butyl prop-2-enoate;methyl 2-methylprop-2-enoate;methyl prop-2-enoate;prop-2-enyl 2-methylprop-2-enoate;styrene
CID 170852470
Propanedioic acid, [(dimethylphenylsilyl)methylene]-, diethyl ester
CID 11370227
1-[(Methacryloyloxy)methyl]-dimethyl,3,3,3-triphenyldisiloxane
CID 20267291
Butyl prop-2-enoate;methyl 2-methylprop-2-enoate;styrene;3-trimethoxysilylpropyl 2-methylprop-2-enoate
CID 67843031
Styrene;3-trimethoxysilylpropyl 2-methylprop-2-enoate
CID 70407419
Styrene Methyl Methacrylate Trimethoxysilylpropyl Methacrylate
CID 86762181
Dihydroxy(diphenyl)silane;3-trimethoxysilylpropyl 2-methylprop-2-enoate
CID 161878353
(Diphenylsilylene)bis(oxy-2,1-ethanediyl) bismethacrylate
CID 87093
3-[Diethyl(phenyl)silyl]oxypropyl 3-fluoroprop-2-enoate
CID 53685011

Frequently Asked Questions

What is the IUPAC name of trimethoxy(methyl)silane;trimethoxy(phenyl)silane;3-trimethoxysilylpropyl 2-methylprop-2-enoate?
The IUPAC name of trimethoxy(methyl)silane;trimethoxy(phenyl)silane;3-trimethoxysilylpropyl 2-methylprop-2-enoate (CID 170852378) is trimethoxy(methyl)silane;trimethoxy(phenyl)silane;3-trimethoxysilylpropyl 2-methylprop-2-enoate.
What is the SMILES notation for trimethoxy(methyl)silane;trimethoxy(phenyl)silane;3-trimethoxysilylpropyl 2-methylprop-2-enoate?
The canonical SMILES for trimethoxy(methyl)silane;trimethoxy(phenyl)silane;3-trimethoxysilylpropyl 2-methylprop-2-enoate is C=C(C)C(=O)OCCC[Si](OC)(OC)OC.CO[Si](C)(OC)OC.CO[Si](OC)(OC)c1ccccc1.
What is the InChIKey of trimethoxy(methyl)silane;trimethoxy(phenyl)silane;3-trimethoxysilylpropyl 2-methylprop-2-enoate?
The InChIKey is ABMOJSOPYAJKAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O5Si.C9H14O3Si.C4H12O3Si/c1-9(2)10(11)15-7-6-8-16(12-3,13-4)14-5;1-10-13(11-2,12-3)9-7-5-4-6-8-9;1-5-8(4,6-2)7-3/h1,6-8H2,2-5H3;4-8H,1-3H3;1-4H3.
What are the key properties of trimethoxy(methyl)silane;trimethoxy(phenyl)silane;3-trimethoxysilylpropyl 2-methylprop-2-enoate?
trimethoxy(methyl)silane;trimethoxy(phenyl)silane;3-trimethoxysilylpropyl 2-methylprop-2-enoate has a molecular weight of 582.87 g/mol, XLogP of 2.64, 15 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for trimethoxy(methyl)silane;trimethoxy(phenyl)silane;3-trimethoxysilylpropyl 2-methylprop-2-enoate is sourced from PubChem (CID 170852378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).