2-trimethylsilyloxy-2H-furan-5-one

C7H12O3Si — CID 91749621

IUPAC2-trimethylsilyloxy-2H-furan-5-one
SMILESC[Si](C)(C)OC1C=CC(=O)O1
InChIInChI=1S/C7H12O3Si/c1-11(2,3)10-7-5-4-6(8)9-7/h4-5,7H,1-3H3
InChIKeyOLWNNFLDXJEWQF-UHFFFAOYSA-N
MW172.26 g/mol
LogP1.28
Rot. Bonds2

About 2-trimethylsilyloxy-2H-furan-5-one

2-trimethylsilyloxy-2H-furan-5-one (PubChem CID 91749621) has the molecular formula C7H12O3Si and a molecular weight of 172.26 g/mol. Its IUPAC name is 2-trimethylsilyloxy-2H-furan-5-one.

Molecular Properties

Compound Name2-trimethylsilyloxy-2H-furan-5-one
PubChem CID91749621
Molecular FormulaC7H12O3Si
Molecular Weight172.26 g/mol
Exact Mass172.06
IUPAC Name2-trimethylsilyloxy-2H-furan-5-one
SMILESC[Si](C)(C)OC1C=CC(=O)O1
InChIInChI=1S/C7H12O3Si/c1-11(2,3)10-7-5-4-6(8)9-7/h4-5,7H,1-3H3
InChIKeyOLWNNFLDXJEWQF-UHFFFAOYSA-N
XLogP1.28
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.26
LogP ≤ 51.28
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 2-trimethylsilyloxy-2H-furan-5-one?
The IUPAC name of 2-trimethylsilyloxy-2H-furan-5-one (CID 91749621) is 2-trimethylsilyloxy-2H-furan-5-one.
What is the SMILES notation for 2-trimethylsilyloxy-2H-furan-5-one?
The canonical SMILES for 2-trimethylsilyloxy-2H-furan-5-one is C[Si](C)(C)OC1C=CC(=O)O1.
What is the InChIKey of 2-trimethylsilyloxy-2H-furan-5-one?
The InChIKey is OLWNNFLDXJEWQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12O3Si/c1-11(2,3)10-7-5-4-6(8)9-7/h4-5,7H,1-3H3.
What are the key properties of 2-trimethylsilyloxy-2H-furan-5-one?
2-trimethylsilyloxy-2H-furan-5-one has a molecular weight of 172.26 g/mol, XLogP of 1.28, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-trimethylsilyloxy-2H-furan-5-one is sourced from PubChem (CID 91749621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).