2-(2,2-dimethoxyethoxysilyl)ethyl 2-methylprop-2-enoate

C10H20O5Si — CID 154483341

IUPAC2-(2,2-dimethoxyethoxysilyl)ethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCC[SiH2]OCC(OC)OC
InChIInChI=1S/C10H20O5Si/c1-8(2)10(11)14-5-6-16-15-7-9(12-3)13-4/h9H,1,5-7,16H2,2-4H3
InChIKeyJFFYNLANVJLPFA-UHFFFAOYSA-N
MW248.35 g/mol
LogP0.24
Rot. Bonds9

About 2-(2,2-dimethoxyethoxysilyl)ethyl 2-methylprop-2-enoate

2-(2,2-dimethoxyethoxysilyl)ethyl 2-methylprop-2-enoate (PubChem CID 154483341) has the molecular formula C10H20O5Si and a molecular weight of 248.35 g/mol. Its IUPAC name is 2-(2,2-dimethoxyethoxysilyl)ethyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name2-(2,2-dimethoxyethoxysilyl)ethyl 2-methylprop-2-enoate
PubChem CID154483341
Molecular FormulaC10H20O5Si
Molecular Weight248.35 g/mol
Exact Mass248.11
IUPAC Name2-(2,2-dimethoxyethoxysilyl)ethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCC[SiH2]OCC(OC)OC
InChIInChI=1S/C10H20O5Si/c1-8(2)10(11)14-5-6-16-15-7-9(12-3)13-4/h9H,1,5-7,16H2,2-4H3
InChIKeyJFFYNLANVJLPFA-UHFFFAOYSA-N
XLogP0.24
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.35
LogP ≤ 50.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

2-(2,2-dichloroethoxysilyl)ethyl 2-methylprop-2-enoate
CID 154135001
5-(2,2-dimethoxyethylsilyl)pentyl 2-methylprop-2-enoate
CID 154399955
methyl 2-methylprop-2-enoate;2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate
CID 3080735
3-(2,2,2-trimethoxyethoxysilyl)propyl 2-methylprop-2-enoate
CID 154116228
ethene;2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate
CID 173009937
[3-methoxy-2-(methoxymethyl)propyl] 2-methylprop-2-enoate
CID 58701380
2,3,3-trimethoxypropyl 2-methylprop-2-enoate
CID 123499997
2-(2-methoxypropoxy)ethyl 2-methylprop-2-enoate
CID 20625798
5-methoxyhexyl 2-methylprop-2-enoate
CID 164776175
ethane-1,2-diol;[2-methoxy-2-(2-methylprop-2-enoyloxy)ethyl] 2-methylprop-2-enoate
CID 87169157
2-hydroperoxyethyl 2-methylprop-2-enoate
CID 18987502
2-hydroxyethyl 2-methylprop-2-enoate;nonakis(methyl 2-methylprop-2-enoate)
CID 173405157

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethoxyethoxysilyl)ethyl 2-methylprop-2-enoate?
The IUPAC name of 2-(2,2-dimethoxyethoxysilyl)ethyl 2-methylprop-2-enoate (CID 154483341) is 2-(2,2-dimethoxyethoxysilyl)ethyl 2-methylprop-2-enoate.
What is the SMILES notation for 2-(2,2-dimethoxyethoxysilyl)ethyl 2-methylprop-2-enoate?
The canonical SMILES for 2-(2,2-dimethoxyethoxysilyl)ethyl 2-methylprop-2-enoate is C=C(C)C(=O)OCC[SiH2]OCC(OC)OC.
What is the InChIKey of 2-(2,2-dimethoxyethoxysilyl)ethyl 2-methylprop-2-enoate?
The InChIKey is JFFYNLANVJLPFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O5Si/c1-8(2)10(11)14-5-6-16-15-7-9(12-3)13-4/h9H,1,5-7,16H2,2-4H3.
What are the key properties of 2-(2,2-dimethoxyethoxysilyl)ethyl 2-methylprop-2-enoate?
2-(2,2-dimethoxyethoxysilyl)ethyl 2-methylprop-2-enoate has a molecular weight of 248.35 g/mol, XLogP of 0.24, 9 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethoxyethoxysilyl)ethyl 2-methylprop-2-enoate is sourced from PubChem (CID 154483341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).