methyl 2-(3,4-dimethyl-5-oxo-2-trimethylsilyloxyfuran-2-yl)-2-methylpropanoate

C14H24O5Si — CID 46910367

IUPACmethyl 2-(3,4-dimethyl-5-oxo-2-trimethylsilyloxyfuran-2-yl)-2-methylpropanoate
SMILESCOC(=O)C(C)(C)C1(O[Si](C)(C)C)OC(=O)C(C)=C1C
InChIInChI=1S/C14H24O5Si/c1-9-10(2)14(18-11(9)15,19-20(6,7)8)13(3,4)12(16)17-5/h1-8H3
InChIKeyKQJNLQHIZZUZRT-UHFFFAOYSA-N
MW300.43 g/mol
LogP2.63
Rot. Bonds4

About methyl 2-(3,4-dimethyl-5-oxo-2-trimethylsilyloxyfuran-2-yl)-2-methylpropanoate

methyl 2-(3,4-dimethyl-5-oxo-2-trimethylsilyloxyfuran-2-yl)-2-methylpropanoate (PubChem CID 46910367) has the molecular formula C14H24O5Si and a molecular weight of 300.43 g/mol. Its IUPAC name is methyl 2-(3,4-dimethyl-5-oxo-2-trimethylsilyloxyfuran-2-yl)-2-methylpropanoate.

Molecular Properties

Compound Namemethyl 2-(3,4-dimethyl-5-oxo-2-trimethylsilyloxyfuran-2-yl)-2-methylpropanoate
PubChem CID46910367
Molecular FormulaC14H24O5Si
Molecular Weight300.43 g/mol
Exact Mass300.14
IUPAC Namemethyl 2-(3,4-dimethyl-5-oxo-2-trimethylsilyloxyfuran-2-yl)-2-methylpropanoate
SMILESCOC(=O)C(C)(C)C1(O[Si](C)(C)C)OC(=O)C(C)=C1C
InChIInChI=1S/C14H24O5Si/c1-9-10(2)14(18-11(9)15,19-20(6,7)8)13(3,4)12(16)17-5/h1-8H3
InChIKeyKQJNLQHIZZUZRT-UHFFFAOYSA-N
XLogP2.63
TPSA61.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.43
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

Dimethyl 2,2,5-trimethyl-5-trimethylsilyloxyfuran-3,4-dicarboxylate
CID 11099128
Methyl 2-methoxy-5-oxo-2-propan-2-yl-4-trimethylsilylfuran-3-carboxylate
CID 10660893
Methyl 2-methyl-2-(3-methyl-5-oxo-2-trimethylsilyloxyfuran-2-yl)propanoate
CID 46910298
Methyl 2-(2-hydroxy-3,4-dimethyl-5-oxofuran-2-yl)-2-methylpropanoate
CID 46910368

Frequently Asked Questions

What is the IUPAC name of methyl 2-(3,4-dimethyl-5-oxo-2-trimethylsilyloxyfuran-2-yl)-2-methylpropanoate?
The IUPAC name of methyl 2-(3,4-dimethyl-5-oxo-2-trimethylsilyloxyfuran-2-yl)-2-methylpropanoate (CID 46910367) is methyl 2-(3,4-dimethyl-5-oxo-2-trimethylsilyloxyfuran-2-yl)-2-methylpropanoate.
What is the SMILES notation for methyl 2-(3,4-dimethyl-5-oxo-2-trimethylsilyloxyfuran-2-yl)-2-methylpropanoate?
The canonical SMILES for methyl 2-(3,4-dimethyl-5-oxo-2-trimethylsilyloxyfuran-2-yl)-2-methylpropanoate is COC(=O)C(C)(C)C1(O[Si](C)(C)C)OC(=O)C(C)=C1C.
What is the InChIKey of methyl 2-(3,4-dimethyl-5-oxo-2-trimethylsilyloxyfuran-2-yl)-2-methylpropanoate?
The InChIKey is KQJNLQHIZZUZRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O5Si/c1-9-10(2)14(18-11(9)15,19-20(6,7)8)13(3,4)12(16)17-5/h1-8H3.
What are the key properties of methyl 2-(3,4-dimethyl-5-oxo-2-trimethylsilyloxyfuran-2-yl)-2-methylpropanoate?
methyl 2-(3,4-dimethyl-5-oxo-2-trimethylsilyloxyfuran-2-yl)-2-methylpropanoate has a molecular weight of 300.43 g/mol, XLogP of 2.63, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(3,4-dimethyl-5-oxo-2-trimethylsilyloxyfuran-2-yl)-2-methylpropanoate is sourced from PubChem (CID 46910367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).