2-phenyl-4-trimethylsilyl-2H-furan-5-one

C13H16O2Si — CID 11241759

IUPAC2-phenyl-4-trimethylsilyl-2H-furan-5-one
SMILESC[Si](C)(C)C1=CC(c2ccccc2)OC1=O
InChIInChI=1S/C13H16O2Si/c1-16(2,3)12-9-11(15-13(12)14)10-7-5-4-6-8-10/h4-9,11H,1-3H3
InChIKeySHDMCYHCDBVLGS-UHFFFAOYSA-N
MW232.35 g/mol
LogP3.09
Rot. Bonds2

About 2-phenyl-4-trimethylsilyl-2H-furan-5-one

2-phenyl-4-trimethylsilyl-2H-furan-5-one (PubChem CID 11241759) has the molecular formula C13H16O2Si and a molecular weight of 232.35 g/mol. Its IUPAC name is 2-phenyl-4-trimethylsilyl-2H-furan-5-one.

Molecular Properties

Compound Name2-phenyl-4-trimethylsilyl-2H-furan-5-one
PubChem CID11241759
Molecular FormulaC13H16O2Si
Molecular Weight232.35 g/mol
Exact Mass232.09
IUPAC Name2-phenyl-4-trimethylsilyl-2H-furan-5-one
SMILESC[Si](C)(C)C1=CC(c2ccccc2)OC1=O
InChIInChI=1S/C13H16O2Si/c1-16(2,3)12-9-11(15-13(12)14)10-7-5-4-6-8-10/h4-9,11H,1-3H3
InChIKeySHDMCYHCDBVLGS-UHFFFAOYSA-N
XLogP3.09
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-nitroso-2-phenyl-2H-furan-5-one
CID 143051347
(2S)-2-phenyl-4-prop-2-enyl-2H-furan-5-one
CID 71421512
2-propan-2-yl-4-trimethylsilyl-2H-furan-5-one
CID 102462327
(5R)-3-methyl-5-phenyl-2,5-dihydro-1,2-oxazole
CID 123675513
5,7-dimethoxy-2-phenyl-2H-1-benzofuran-4-one
CID 154641182
(3R,6R)-3,6-diphenyl-1,4-dioxane-2,5-dione
CID 101432935
(3R,6S)-3,6-diphenyl-1,4-dioxane-2,5-dione
CID 101432934
1,4-diphenyl-1,3a,4,6a-tetrahydrofuro[3,4-c]furan-3,6-dione
CID 13310359
(2R)-4-methyl-3-[(2R)-4-methyl-5-oxo-2-phenyl-2H-furan-3-yl]-2-phenyl-2H-furan-5-one
CID 102397882
9-methyl-2,4-diphenyl-2H-pyrano[3,2-c]chromen-5-one
CID 132943016
(4R,5R)-4-(4-methylphenyl)-5-phenyl-1,3-dioxolan-2-one
CID 177461861
(3R,4R,5S)-3,4-dimethyl-5-phenyloxolan-2-one
CID 101000241

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-4-trimethylsilyl-2H-furan-5-one?
The IUPAC name of 2-phenyl-4-trimethylsilyl-2H-furan-5-one (CID 11241759) is 2-phenyl-4-trimethylsilyl-2H-furan-5-one.
What is the SMILES notation for 2-phenyl-4-trimethylsilyl-2H-furan-5-one?
The canonical SMILES for 2-phenyl-4-trimethylsilyl-2H-furan-5-one is C[Si](C)(C)C1=CC(c2ccccc2)OC1=O.
What is the InChIKey of 2-phenyl-4-trimethylsilyl-2H-furan-5-one?
The InChIKey is SHDMCYHCDBVLGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16O2Si/c1-16(2,3)12-9-11(15-13(12)14)10-7-5-4-6-8-10/h4-9,11H,1-3H3.
What are the key properties of 2-phenyl-4-trimethylsilyl-2H-furan-5-one?
2-phenyl-4-trimethylsilyl-2H-furan-5-one has a molecular weight of 232.35 g/mol, XLogP of 3.09, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-4-trimethylsilyl-2H-furan-5-one is sourced from PubChem (CID 11241759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).