[acetyloxy(diethoxy)silyl]methyl 2-methylprop-2-enoate

C11H20O6Si — CID 22457247

IUPAC[acetyloxy(diethoxy)silyl]methyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OC[Si](OCC)(OCC)OC(C)=O
InChIInChI=1S/C11H20O6Si/c1-6-15-18(16-7-2,17-10(5)12)8-14-11(13)9(3)4/h3,6-8H2,1-2,4-5H3
InChIKeyLVIMGZLHIQUCQT-UHFFFAOYSA-N
MW276.36 g/mol
LogP1.22
Rot. Bonds8

About [acetyloxy(diethoxy)silyl]methyl 2-methylprop-2-enoate

[acetyloxy(diethoxy)silyl]methyl 2-methylprop-2-enoate (PubChem CID 22457247) has the molecular formula C11H20O6Si and a molecular weight of 276.36 g/mol. Its IUPAC name is [acetyloxy(diethoxy)silyl]methyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name[acetyloxy(diethoxy)silyl]methyl 2-methylprop-2-enoate
PubChem CID22457247
Molecular FormulaC11H20O6Si
Molecular Weight276.36 g/mol
Exact Mass276.10
IUPAC Name[acetyloxy(diethoxy)silyl]methyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OC[Si](OCC)(OCC)OC(C)=O
InChIInChI=1S/C11H20O6Si/c1-6-15-18(16-7-2,17-10(5)12)8-14-11(13)9(3)4/h3,6-8H2,1-2,4-5H3
InChIKeyLVIMGZLHIQUCQT-UHFFFAOYSA-N
XLogP1.22
TPSA71.06 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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 [acetyloxy(diethoxy)silyl]methyl 2-methylprop-2-enoate?
The IUPAC name of [acetyloxy(diethoxy)silyl]methyl 2-methylprop-2-enoate (CID 22457247) is [acetyloxy(diethoxy)silyl]methyl 2-methylprop-2-enoate.
What is the SMILES notation for [acetyloxy(diethoxy)silyl]methyl 2-methylprop-2-enoate?
The canonical SMILES for [acetyloxy(diethoxy)silyl]methyl 2-methylprop-2-enoate is C=C(C)C(=O)OC[Si](OCC)(OCC)OC(C)=O.
What is the InChIKey of [acetyloxy(diethoxy)silyl]methyl 2-methylprop-2-enoate?
The InChIKey is LVIMGZLHIQUCQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O6Si/c1-6-15-18(16-7-2,17-10(5)12)8-14-11(13)9(3)4/h3,6-8H2,1-2,4-5H3.
What are the key properties of [acetyloxy(diethoxy)silyl]methyl 2-methylprop-2-enoate?
[acetyloxy(diethoxy)silyl]methyl 2-methylprop-2-enoate has a molecular weight of 276.36 g/mol, XLogP of 1.22, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [acetyloxy(diethoxy)silyl]methyl 2-methylprop-2-enoate is sourced from PubChem (CID 22457247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).