2-[diethoxy(methyl)silyl]ethyl prop-2-enoate

C10H20O4Si — CID 15334987

IUPAC2-[diethoxy(methyl)silyl]ethyl prop-2-enoate
SMILESC=CC(=O)OCC[Si](C)(OCC)OCC
InChIInChI=1S/C10H20O4Si/c1-5-10(11)12-8-9-15(4,13-6-2)14-7-3/h5H,1,6-9H2,2-4H3
InChIKeyXJQCUIPISBNYLK-UHFFFAOYSA-N
MW232.35 g/mol
LogP1.86
Rot. Bonds8

About 2-[diethoxy(methyl)silyl]ethyl prop-2-enoate

2-[diethoxy(methyl)silyl]ethyl prop-2-enoate (PubChem CID 15334987) has the molecular formula C10H20O4Si and a molecular weight of 232.35 g/mol. Its IUPAC name is 2-[diethoxy(methyl)silyl]ethyl prop-2-enoate.

Molecular Properties

Compound Name2-[diethoxy(methyl)silyl]ethyl prop-2-enoate
PubChem CID15334987
Molecular FormulaC10H20O4Si
Molecular Weight232.35 g/mol
Exact Mass232.11
IUPAC Name2-[diethoxy(methyl)silyl]ethyl prop-2-enoate
SMILESC=CC(=O)OCC[Si](C)(OCC)OCC
InChIInChI=1S/C10H20O4Si/c1-5-10(11)12-8-9-15(4,13-6-2)14-7-3/h5H,1,6-9H2,2-4H3
InChIKeyXJQCUIPISBNYLK-UHFFFAOYSA-N
XLogP1.86
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[diethoxy(methyl)silyl]ethyl prop-2-enoate?
The IUPAC name of 2-[diethoxy(methyl)silyl]ethyl prop-2-enoate (CID 15334987) is 2-[diethoxy(methyl)silyl]ethyl prop-2-enoate.
What is the SMILES notation for 2-[diethoxy(methyl)silyl]ethyl prop-2-enoate?
The canonical SMILES for 2-[diethoxy(methyl)silyl]ethyl prop-2-enoate is C=CC(=O)OCC[Si](C)(OCC)OCC.
What is the InChIKey of 2-[diethoxy(methyl)silyl]ethyl prop-2-enoate?
The InChIKey is XJQCUIPISBNYLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O4Si/c1-5-10(11)12-8-9-15(4,13-6-2)14-7-3/h5H,1,6-9H2,2-4H3.
What are the key properties of 2-[diethoxy(methyl)silyl]ethyl prop-2-enoate?
2-[diethoxy(methyl)silyl]ethyl prop-2-enoate has a molecular weight of 232.35 g/mol, XLogP of 1.86, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[diethoxy(methyl)silyl]ethyl prop-2-enoate is sourced from PubChem (CID 15334987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).