methyl 2-(4,4-dimethyl-2-oxo-3-trimethylsilyloxyoxolan-3-yl)-2-methylpropanoate

C14H26O5Si — CID 11822800

IUPACmethyl 2-(4,4-dimethyl-2-oxo-3-trimethylsilyloxyoxolan-3-yl)-2-methylpropanoate
SMILESCOC(=O)C(C)(C)C1(O[Si](C)(C)C)C(=O)OCC1(C)C
InChIInChI=1S/C14H26O5Si/c1-12(2)9-18-11(16)14(12,19-20(6,7)8)13(3,4)10(15)17-5/h9H2,1-8H3
InChIKeyYKDFODVEXBLJAN-UHFFFAOYSA-N
MW302.44 g/mol
LogP2.36
Rot. Bonds4

About methyl 2-(4,4-dimethyl-2-oxo-3-trimethylsilyloxyoxolan-3-yl)-2-methylpropanoate

methyl 2-(4,4-dimethyl-2-oxo-3-trimethylsilyloxyoxolan-3-yl)-2-methylpropanoate (PubChem CID 11822800) has the molecular formula C14H26O5Si and a molecular weight of 302.44 g/mol. Its IUPAC name is methyl 2-(4,4-dimethyl-2-oxo-3-trimethylsilyloxyoxolan-3-yl)-2-methylpropanoate.

Molecular Properties

Compound Namemethyl 2-(4,4-dimethyl-2-oxo-3-trimethylsilyloxyoxolan-3-yl)-2-methylpropanoate
PubChem CID11822800
Molecular FormulaC14H26O5Si
Molecular Weight302.44 g/mol
Exact Mass302.15
IUPAC Namemethyl 2-(4,4-dimethyl-2-oxo-3-trimethylsilyloxyoxolan-3-yl)-2-methylpropanoate
SMILESCOC(=O)C(C)(C)C1(O[Si](C)(C)C)C(=O)OCC1(C)C
InChIInChI=1S/C14H26O5Si/c1-12(2)9-18-11(16)14(12,19-20(6,7)8)13(3,4)10(15)17-5/h9H2,1-8H3
InChIKeyYKDFODVEXBLJAN-UHFFFAOYSA-N
XLogP2.36
TPSA61.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.44
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze methyl 2-(4,4-dimethyl-2-oxo-3-trimethylsilyloxyoxolan-3-yl)-2-methylpropanoate with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of methyl 2-(4,4-dimethyl-2-oxo-3-trimethylsilyloxyoxolan-3-yl)-2-methylpropanoate?
The IUPAC name of methyl 2-(4,4-dimethyl-2-oxo-3-trimethylsilyloxyoxolan-3-yl)-2-methylpropanoate (CID 11822800) is methyl 2-(4,4-dimethyl-2-oxo-3-trimethylsilyloxyoxolan-3-yl)-2-methylpropanoate.
What is the SMILES notation for methyl 2-(4,4-dimethyl-2-oxo-3-trimethylsilyloxyoxolan-3-yl)-2-methylpropanoate?
The canonical SMILES for methyl 2-(4,4-dimethyl-2-oxo-3-trimethylsilyloxyoxolan-3-yl)-2-methylpropanoate is COC(=O)C(C)(C)C1(O[Si](C)(C)C)C(=O)OCC1(C)C.
What is the InChIKey of methyl 2-(4,4-dimethyl-2-oxo-3-trimethylsilyloxyoxolan-3-yl)-2-methylpropanoate?
The InChIKey is YKDFODVEXBLJAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O5Si/c1-12(2)9-18-11(16)14(12,19-20(6,7)8)13(3,4)10(15)17-5/h9H2,1-8H3.
What are the key properties of methyl 2-(4,4-dimethyl-2-oxo-3-trimethylsilyloxyoxolan-3-yl)-2-methylpropanoate?
methyl 2-(4,4-dimethyl-2-oxo-3-trimethylsilyloxyoxolan-3-yl)-2-methylpropanoate has a molecular weight of 302.44 g/mol, XLogP of 2.36, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(4,4-dimethyl-2-oxo-3-trimethylsilyloxyoxolan-3-yl)-2-methylpropanoate is sourced from PubChem (CID 11822800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).