[dimethyl(2-methylpropanoyloxy)silyl] 2-methylpropanoate

C10H20O4Si — CID 170847746

IUPAC[dimethyl(2-methylpropanoyloxy)silyl] 2-methylpropanoate
SMILESCC(C)C(=O)O[Si](C)(C)OC(=O)C(C)C
InChIInChI=1S/C10H20O4Si/c1-7(2)9(11)13-15(5,6)14-10(12)8(3)4/h7-8H,1-6H3
InChIKeyKLKKFTRQAUHQQL-UHFFFAOYSA-N
MW232.35 g/mol
LogP2.09
Rot. Bonds4

About [dimethyl(2-methylpropanoyloxy)silyl] 2-methylpropanoate

[dimethyl(2-methylpropanoyloxy)silyl] 2-methylpropanoate (PubChem CID 170847746) has the molecular formula C10H20O4Si and a molecular weight of 232.35 g/mol. Its IUPAC name is [dimethyl(2-methylpropanoyloxy)silyl] 2-methylpropanoate.

Molecular Properties

Compound Name[dimethyl(2-methylpropanoyloxy)silyl] 2-methylpropanoate
PubChem CID170847746
Molecular FormulaC10H20O4Si
Molecular Weight232.35 g/mol
Exact Mass232.11
IUPAC Name[dimethyl(2-methylpropanoyloxy)silyl] 2-methylpropanoate
SMILESCC(C)C(=O)O[Si](C)(C)OC(=O)C(C)C
InChIInChI=1S/C10H20O4Si/c1-7(2)9(11)13-15(5,6)14-10(12)8(3)4/h7-8H,1-6H3
InChIKeyKLKKFTRQAUHQQL-UHFFFAOYSA-N
XLogP2.09
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [dimethyl(2-methylpropanoyloxy)silyl] 2-methylpropanoate?
The IUPAC name of [dimethyl(2-methylpropanoyloxy)silyl] 2-methylpropanoate (CID 170847746) is [dimethyl(2-methylpropanoyloxy)silyl] 2-methylpropanoate.
What is the SMILES notation for [dimethyl(2-methylpropanoyloxy)silyl] 2-methylpropanoate?
The canonical SMILES for [dimethyl(2-methylpropanoyloxy)silyl] 2-methylpropanoate is CC(C)C(=O)O[Si](C)(C)OC(=O)C(C)C.
What is the InChIKey of [dimethyl(2-methylpropanoyloxy)silyl] 2-methylpropanoate?
The InChIKey is KLKKFTRQAUHQQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O4Si/c1-7(2)9(11)13-15(5,6)14-10(12)8(3)4/h7-8H,1-6H3.
What are the key properties of [dimethyl(2-methylpropanoyloxy)silyl] 2-methylpropanoate?
[dimethyl(2-methylpropanoyloxy)silyl] 2-methylpropanoate has a molecular weight of 232.35 g/mol, XLogP of 2.09, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [dimethyl(2-methylpropanoyloxy)silyl] 2-methylpropanoate is sourced from PubChem (CID 170847746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).