5-ethyl-3-(1-trimethylsilyloxyethenyl)oxolan-2-one

C11H20O3Si — CID 121006359

IUPAC5-ethyl-3-(1-trimethylsilyloxyethenyl)oxolan-2-one
SMILESC=C(O[Si](C)(C)C)C1CC(CC)OC1=O
InChIInChI=1S/C11H20O3Si/c1-6-9-7-10(11(12)13-9)8(2)14-15(3,4)5/h9-10H,2,6-7H2,1,3-5H3
InChIKeyCFSPOBSKBMXQNY-UHFFFAOYSA-N
MW228.36 g/mol
LogP2.69
Rot. Bonds4

About 5-ethyl-3-(1-trimethylsilyloxyethenyl)oxolan-2-one

5-ethyl-3-(1-trimethylsilyloxyethenyl)oxolan-2-one (PubChem CID 121006359) has the molecular formula C11H20O3Si and a molecular weight of 228.36 g/mol. Its IUPAC name is 5-ethyl-3-(1-trimethylsilyloxyethenyl)oxolan-2-one.

Molecular Properties

Compound Name5-ethyl-3-(1-trimethylsilyloxyethenyl)oxolan-2-one
PubChem CID121006359
Molecular FormulaC11H20O3Si
Molecular Weight228.36 g/mol
Exact Mass228.12
IUPAC Name5-ethyl-3-(1-trimethylsilyloxyethenyl)oxolan-2-one
SMILESC=C(O[Si](C)(C)C)C1CC(CC)OC1=O
InChIInChI=1S/C11H20O3Si/c1-6-9-7-10(11(12)13-9)8(2)14-15(3,4)5/h9-10H,2,6-7H2,1,3-5H3
InChIKeyCFSPOBSKBMXQNY-UHFFFAOYSA-N
XLogP2.69
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.36
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-(1-trimethylsilyloxyethenyl)oxolan-2-one?
The IUPAC name of 5-ethyl-3-(1-trimethylsilyloxyethenyl)oxolan-2-one (CID 121006359) is 5-ethyl-3-(1-trimethylsilyloxyethenyl)oxolan-2-one.
What is the SMILES notation for 5-ethyl-3-(1-trimethylsilyloxyethenyl)oxolan-2-one?
The canonical SMILES for 5-ethyl-3-(1-trimethylsilyloxyethenyl)oxolan-2-one is C=C(O[Si](C)(C)C)C1CC(CC)OC1=O.
What is the InChIKey of 5-ethyl-3-(1-trimethylsilyloxyethenyl)oxolan-2-one?
The InChIKey is CFSPOBSKBMXQNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O3Si/c1-6-9-7-10(11(12)13-9)8(2)14-15(3,4)5/h9-10H,2,6-7H2,1,3-5H3.
What are the key properties of 5-ethyl-3-(1-trimethylsilyloxyethenyl)oxolan-2-one?
5-ethyl-3-(1-trimethylsilyloxyethenyl)oxolan-2-one has a molecular weight of 228.36 g/mol, XLogP of 2.69, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-(1-trimethylsilyloxyethenyl)oxolan-2-one is sourced from PubChem (CID 121006359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).