2-[3-[ethoxy(dimethoxy)silyl]propoxy]ethyl prop-2-enoate

C12H24O6Si — CID 141313483

IUPAC2-[3-[ethoxy(dimethoxy)silyl]propoxy]ethyl prop-2-enoate
SMILESC=CC(=O)OCCOCCC[Si](OC)(OC)OCC
InChIInChI=1S/C12H24O6Si/c1-5-12(13)17-10-9-16-8-7-11-19(14-3,15-4)18-6-2/h5H,1,6-11H2,2-4H3
InChIKeyARNZEGDGIBUQOE-UHFFFAOYSA-N
MW292.40 g/mol
LogP1.39
Rot. Bonds12

About 2-[3-[ethoxy(dimethoxy)silyl]propoxy]ethyl prop-2-enoate

2-[3-[ethoxy(dimethoxy)silyl]propoxy]ethyl prop-2-enoate (PubChem CID 141313483) has the molecular formula C12H24O6Si and a molecular weight of 292.40 g/mol. Its IUPAC name is 2-[3-[ethoxy(dimethoxy)silyl]propoxy]ethyl prop-2-enoate.

Molecular Properties

Compound Name2-[3-[ethoxy(dimethoxy)silyl]propoxy]ethyl prop-2-enoate
PubChem CID141313483
Molecular FormulaC12H24O6Si
Molecular Weight292.40 g/mol
Exact Mass292.13
IUPAC Name2-[3-[ethoxy(dimethoxy)silyl]propoxy]ethyl prop-2-enoate
SMILESC=CC(=O)OCCOCCC[Si](OC)(OC)OCC
InChIInChI=1S/C12H24O6Si/c1-5-12(13)17-10-9-16-8-7-11-19(14-3,15-4)18-6-2/h5H,1,6-11H2,2-4H3
InChIKeyARNZEGDGIBUQOE-UHFFFAOYSA-N
XLogP1.39
TPSA63.22 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.40
LogP ≤ 51.39
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': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze 2-[3-[ethoxy(dimethoxy)silyl]propoxy]ethyl prop-2-enoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

9-[ethoxy(dimethoxy)silyl]nonyl prop-2-enoate
CID 170945913
2-[2-(2-trimethoxysilylethoxy)ethoxy]ethyl prop-2-enoate
CID 171586967
prop-2-enoic acid;3-triethoxysilylpropyl prop-2-enoate
CID 158718289
3-[dimethoxy(methyl)silyl]propyl prop-2-enoate;3-triethoxysilylpropyl prop-2-enoate
CID 87188845
3-trimethoxysilylpropyl prop-2-enoate;hydrate
CID 141437630
3-[3-(2-trimethoxysilylethoxy)propoxy]propyl prop-2-enoate
CID 171586982
3-[[dimethoxy(3-prop-2-enoyloxypropyl)silyl]oxy-dimethoxysilyl]propyl prop-2-enoate
CID 18468769
phosphoric acid;3-trimethoxysilylpropyl prop-2-enoate
CID 174981814
2-[diethoxy(undecyl)silyl]oxyethyl prop-2-enoate
CID 151648316
2-[2-[2-[2-[2-(3-trimethoxysilylpropylcarbamoyloxy)ethoxy]ethoxy]ethoxy]ethoxycarbonylamino]ethyl prop-2-enoate
CID 162702779
CID 166519746
CID 166519746
3-[3-tris(trimethylsilyloxy)silylpropoxy]propyl prop-2-enoate
CID 59642122

Frequently Asked Questions

What is the IUPAC name of 2-[3-[ethoxy(dimethoxy)silyl]propoxy]ethyl prop-2-enoate?
The IUPAC name of 2-[3-[ethoxy(dimethoxy)silyl]propoxy]ethyl prop-2-enoate (CID 141313483) is 2-[3-[ethoxy(dimethoxy)silyl]propoxy]ethyl prop-2-enoate.
What is the SMILES notation for 2-[3-[ethoxy(dimethoxy)silyl]propoxy]ethyl prop-2-enoate?
The canonical SMILES for 2-[3-[ethoxy(dimethoxy)silyl]propoxy]ethyl prop-2-enoate is C=CC(=O)OCCOCCC[Si](OC)(OC)OCC.
What is the InChIKey of 2-[3-[ethoxy(dimethoxy)silyl]propoxy]ethyl prop-2-enoate?
The InChIKey is ARNZEGDGIBUQOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O6Si/c1-5-12(13)17-10-9-16-8-7-11-19(14-3,15-4)18-6-2/h5H,1,6-11H2,2-4H3.
What are the key properties of 2-[3-[ethoxy(dimethoxy)silyl]propoxy]ethyl prop-2-enoate?
2-[3-[ethoxy(dimethoxy)silyl]propoxy]ethyl prop-2-enoate has a molecular weight of 292.40 g/mol, XLogP of 1.39, 12 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[ethoxy(dimethoxy)silyl]propoxy]ethyl prop-2-enoate is sourced from PubChem (CID 141313483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).