5-[fluoro(dimethyl)silyl]-2-benzofuran-1,3-dione

C10H9FO3Si — CID 23116704

IUPAC5-[fluoro(dimethyl)silyl]-2-benzofuran-1,3-dione
SMILESC[Si](C)(F)c1ccc2c(c1)C(=O)OC2=O
InChIInChI=1S/C10H9FO3Si/c1-15(2,11)6-3-4-7-8(5-6)10(13)14-9(7)12/h3-5H,1-2H3
InChIKeyCABVUKYRLOALEA-UHFFFAOYSA-N
MW224.26 g/mol
LogP1.38
Rot. Bonds1

About 5-[fluoro(dimethyl)silyl]-2-benzofuran-1,3-dione

5-[fluoro(dimethyl)silyl]-2-benzofuran-1,3-dione (PubChem CID 23116704) has the molecular formula C10H9FO3Si and a molecular weight of 224.26 g/mol. Its IUPAC name is 5-[fluoro(dimethyl)silyl]-2-benzofuran-1,3-dione.

Molecular Properties

Compound Name5-[fluoro(dimethyl)silyl]-2-benzofuran-1,3-dione
PubChem CID23116704
Molecular FormulaC10H9FO3Si
Molecular Weight224.26 g/mol
Exact Mass224.03
IUPAC Name5-[fluoro(dimethyl)silyl]-2-benzofuran-1,3-dione
SMILESC[Si](C)(F)c1ccc2c(c1)C(=O)OC2=O
InChIInChI=1S/C10H9FO3Si/c1-15(2,11)6-3-4-7-8(5-6)10(13)14-9(7)12/h3-5H,1-2H3
InChIKeyCABVUKYRLOALEA-UHFFFAOYSA-N
XLogP1.38
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 51.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-[fluoro(dimethyl)silyl]-2-benzofuran-1,3-dione?
The IUPAC name of 5-[fluoro(dimethyl)silyl]-2-benzofuran-1,3-dione (CID 23116704) is 5-[fluoro(dimethyl)silyl]-2-benzofuran-1,3-dione.
What is the SMILES notation for 5-[fluoro(dimethyl)silyl]-2-benzofuran-1,3-dione?
The canonical SMILES for 5-[fluoro(dimethyl)silyl]-2-benzofuran-1,3-dione is C[Si](C)(F)c1ccc2c(c1)C(=O)OC2=O.
What is the InChIKey of 5-[fluoro(dimethyl)silyl]-2-benzofuran-1,3-dione?
The InChIKey is CABVUKYRLOALEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FO3Si/c1-15(2,11)6-3-4-7-8(5-6)10(13)14-9(7)12/h3-5H,1-2H3.
What are the key properties of 5-[fluoro(dimethyl)silyl]-2-benzofuran-1,3-dione?
5-[fluoro(dimethyl)silyl]-2-benzofuran-1,3-dione has a molecular weight of 224.26 g/mol, XLogP of 1.38, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[fluoro(dimethyl)silyl]-2-benzofuran-1,3-dione is sourced from PubChem (CID 23116704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).