5-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-fluorofuran-2-one

C11H19FO3Si — CID 67491964

IUPAC5-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-fluorofuran-2-one
SMILESCC(C)(C)[Si](C)(C)OCC1(F)C=CC(=O)O1
InChIInChI=1S/C11H19FO3Si/c1-10(2,3)16(4,5)14-8-11(12)7-6-9(13)15-11/h6-7H,8H2,1-5H3
InChIKeyJTNBAZNRIQPQQW-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.79
Rot. Bonds3

About 5-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-fluorofuran-2-one

5-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-fluorofuran-2-one (PubChem CID 67491964) has the molecular formula C11H19FO3Si and a molecular weight of 246.35 g/mol. Its IUPAC name is 5-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-fluorofuran-2-one.

Molecular Properties

Compound Name5-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-fluorofuran-2-one
PubChem CID67491964
Molecular FormulaC11H19FO3Si
Molecular Weight246.35 g/mol
Exact Mass246.11
IUPAC Name5-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-fluorofuran-2-one
SMILESCC(C)(C)[Si](C)(C)OCC1(F)C=CC(=O)O1
InChIInChI=1S/C11H19FO3Si/c1-10(2,3)16(4,5)14-8-11(12)7-6-9(13)15-11/h6-7H,8H2,1-5H3
InChIKeyJTNBAZNRIQPQQW-UHFFFAOYSA-N
XLogP2.79
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 5-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-fluorofuran-2-one?
The IUPAC name of 5-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-fluorofuran-2-one (CID 67491964) is 5-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-fluorofuran-2-one.
What is the SMILES notation for 5-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-fluorofuran-2-one?
The canonical SMILES for 5-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-fluorofuran-2-one is CC(C)(C)[Si](C)(C)OCC1(F)C=CC(=O)O1.
What is the InChIKey of 5-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-fluorofuran-2-one?
The InChIKey is JTNBAZNRIQPQQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19FO3Si/c1-10(2,3)16(4,5)14-8-11(12)7-6-9(13)15-11/h6-7H,8H2,1-5H3.
What are the key properties of 5-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-fluorofuran-2-one?
5-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-fluorofuran-2-one has a molecular weight of 246.35 g/mol, XLogP of 2.79, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-fluorofuran-2-one is sourced from PubChem (CID 67491964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).