2-(trimethylsilyloxymethyl)-2H-furan-5-one

C8H14O3Si — CID 20816445

IUPAC2-(trimethylsilyloxymethyl)-2H-furan-5-one
SMILESC[Si](C)(C)OCC1C=CC(=O)O1
InChIInChI=1S/C8H14O3Si/c1-12(2,3)10-6-7-4-5-8(9)11-7/h4-5,7H,6H2,1-3H3
InChIKeyJIRRHLOHOISHCE-UHFFFAOYSA-N
MW186.28 g/mol
LogP1.32
Rot. Bonds3

About 2-(trimethylsilyloxymethyl)-2H-furan-5-one

2-(trimethylsilyloxymethyl)-2H-furan-5-one (PubChem CID 20816445) has the molecular formula C8H14O3Si and a molecular weight of 186.28 g/mol. Its IUPAC name is 2-(trimethylsilyloxymethyl)-2H-furan-5-one.

Molecular Properties

Compound Name2-(trimethylsilyloxymethyl)-2H-furan-5-one
PubChem CID20816445
Molecular FormulaC8H14O3Si
Molecular Weight186.28 g/mol
Exact Mass186.07
IUPAC Name2-(trimethylsilyloxymethyl)-2H-furan-5-one
SMILESC[Si](C)(C)OCC1C=CC(=O)O1
InChIInChI=1S/C8H14O3Si/c1-12(2,3)10-6-7-4-5-8(9)11-7/h4-5,7H,6H2,1-3H3
InChIKeyJIRRHLOHOISHCE-UHFFFAOYSA-N
XLogP1.32
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.28
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2R)-2-[(2-methylpropan-2-yl)oxymethyl]-2H-furan-5-one
CID 13391762
2-(phenoxymethyl)-2H-furan-5-one
CID 11275514
[(2S)-5-oxo-2H-furan-2-yl]methyl sulfamate
CID 62705949
2-trimethylsilyloxy-2H-furan-5-one
CID 91749621
2-(2-hydroxyethyl)-2H-furan-5-one
CID 11535562
2-(oxan-2-yloxymethyl)-2H-furan-5-one
CID 14432035
3-(5-oxo-2H-furan-2-yl)propanal
CID 86229891
2-(3-methyl-2-methylidenebutyl)-2H-furan-5-one
CID 544001
2-benzyl-2H-furan-5-one
CID 13297886
(2R,3S)-2,3-dimethyl-2,3-dihydropyran-6-one
CID 14056133
(2R)-2-[[[(1S)-1-phenylethyl]amino]methyl]-2H-furan-5-one
CID 135026714
(2R)-2-[(6S,7S)-7-hydroxy-6-methyloctyl]-2H-furan-5-one
CID 100582847

Frequently Asked Questions

What is the IUPAC name of 2-(trimethylsilyloxymethyl)-2H-furan-5-one?
The IUPAC name of 2-(trimethylsilyloxymethyl)-2H-furan-5-one (CID 20816445) is 2-(trimethylsilyloxymethyl)-2H-furan-5-one.
What is the SMILES notation for 2-(trimethylsilyloxymethyl)-2H-furan-5-one?
The canonical SMILES for 2-(trimethylsilyloxymethyl)-2H-furan-5-one is C[Si](C)(C)OCC1C=CC(=O)O1.
What is the InChIKey of 2-(trimethylsilyloxymethyl)-2H-furan-5-one?
The InChIKey is JIRRHLOHOISHCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O3Si/c1-12(2,3)10-6-7-4-5-8(9)11-7/h4-5,7H,6H2,1-3H3.
What are the key properties of 2-(trimethylsilyloxymethyl)-2H-furan-5-one?
2-(trimethylsilyloxymethyl)-2H-furan-5-one has a molecular weight of 186.28 g/mol, XLogP of 1.32, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(trimethylsilyloxymethyl)-2H-furan-5-one is sourced from PubChem (CID 20816445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).