3-[dimethoxy(methyl)silyl]propyl 2-methylprop-2-enoate;3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate

C20H40O7Si2 — CID 87862843

IUPAC3-[dimethoxy(methyl)silyl]propyl 2-methylprop-2-enoate;3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCC[Si](C)(C)OC.C=C(C)C(=O)OCCC[Si](C)(OC)OC
InChIInChI=1S/C10H20O4Si.C10H20O3Si/c1-9(2)10(11)14-7-6-8-15(5,12-3)13-4;1-9(2)10(11)13-7-6-8-14(4,5)12-3/h1,6-8H2,2-5H3;1,6-8H2,2-5H3
InChIKeyCIGAURGYSFPCMG-UHFFFAOYSA-N
MW448.71 g/mol
LogP4.21
Rot. Bonds13

About 3-[dimethoxy(methyl)silyl]propyl 2-methylprop-2-enoate;3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate

3-[dimethoxy(methyl)silyl]propyl 2-methylprop-2-enoate;3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate (PubChem CID 87862843) has the molecular formula C20H40O7Si2 and a molecular weight of 448.71 g/mol. Its IUPAC name is 3-[dimethoxy(methyl)silyl]propyl 2-methylprop-2-enoate;3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name3-[dimethoxy(methyl)silyl]propyl 2-methylprop-2-enoate;3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate
PubChem CID87862843
Molecular FormulaC20H40O7Si2
Molecular Weight448.71 g/mol
Exact Mass448.23
IUPAC Name3-[dimethoxy(methyl)silyl]propyl 2-methylprop-2-enoate;3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCC[Si](C)(C)OC.C=C(C)C(=O)OCCC[Si](C)(OC)OC
InChIInChI=1S/C10H20O4Si.C10H20O3Si/c1-9(2)10(11)14-7-6-8-15(5,12-3)13-4;1-9(2)10(11)13-7-6-8-14(4,5)12-3/h1,6-8H2,2-5H3;1,6-8H2,2-5H3
InChIKeyCIGAURGYSFPCMG-UHFFFAOYSA-N
XLogP4.21
TPSA80.29 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds13
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500448.71
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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

11-[methoxy(dimethyl)silyl]undecyl 2-methylprop-2-enoate
CID 142567351
10-[methoxy(dimethyl)silyl]decyl 2-methylprop-2-enoate
CID 142567352
3-[2-[methoxy(dimethyl)silyl]ethyl-dimethylsilyl]propyl 2-methylprop-2-enoate
CID 140912977
3-[methyl-bis(methylperoxy)silyl]propyl 2-methylprop-2-enoate
CID 141453327
3-[2-[dimethyl-[3-(2-methylprop-2-enoyloxy)propyl]silyl]oxyethoxy-dimethylsilyl]propyl 2-methylprop-2-enoate
CID 156628189
3-[3-[2-[dimethoxy(methyl)silyl]ethoxy]propoxy]propyl 2-methylprop-2-enoate
CID 171586980
3-[2-[dimethoxy(methyl)silyl]ethoxy]propyl 2-methylprop-2-enoate
CID 171586989
3-[[3-methoxypropyl(dimethyl)silyl]oxy-dimethylsilyl]propyl 2-methylprop-2-enoate
CID 59651344
3-(hydroxy-methoxy-methylsilyl)propyl 2-methylprop-2-enoate
CID 140965642
CID 19429806
CID 19429806
azane;3-trimethoxysilylpropyl 2-methylprop-2-enoate
CID 174919252
3-[dimethoxy(methyl)silyl]propyl 2-methylprop-2-enoate;(2-methyl-3-trimethoxysilylpropyl) 2-methylprop-2-enoate
CID 87696910

Frequently Asked Questions

What is the IUPAC name of 3-[dimethoxy(methyl)silyl]propyl 2-methylprop-2-enoate;3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate?
The IUPAC name of 3-[dimethoxy(methyl)silyl]propyl 2-methylprop-2-enoate;3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate (CID 87862843) is 3-[dimethoxy(methyl)silyl]propyl 2-methylprop-2-enoate;3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate.
What is the SMILES notation for 3-[dimethoxy(methyl)silyl]propyl 2-methylprop-2-enoate;3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate?
The canonical SMILES for 3-[dimethoxy(methyl)silyl]propyl 2-methylprop-2-enoate;3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate is C=C(C)C(=O)OCCC[Si](C)(C)OC.C=C(C)C(=O)OCCC[Si](C)(OC)OC.
What is the InChIKey of 3-[dimethoxy(methyl)silyl]propyl 2-methylprop-2-enoate;3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate?
The InChIKey is CIGAURGYSFPCMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O4Si.C10H20O3Si/c1-9(2)10(11)14-7-6-8-15(5,12-3)13-4;1-9(2)10(11)13-7-6-8-14(4,5)12-3/h1,6-8H2,2-5H3;1,6-8H2,2-5H3.
What are the key properties of 3-[dimethoxy(methyl)silyl]propyl 2-methylprop-2-enoate;3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate?
3-[dimethoxy(methyl)silyl]propyl 2-methylprop-2-enoate;3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate has a molecular weight of 448.71 g/mol, XLogP of 4.21, 13 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[dimethoxy(methyl)silyl]propyl 2-methylprop-2-enoate;3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate is sourced from PubChem (CID 87862843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).