3-trimethoxysilyloxolane-2,5-dione

C7H12O6Si — CID 15738366

IUPAC3-trimethoxysilyloxolane-2,5-dione
SMILESCO[Si](OC)(OC)C1CC(=O)OC1=O
InChIInChI=1S/C7H12O6Si/c1-10-14(11-2,12-3)5-4-6(8)13-7(5)9/h5H,4H2,1-3H3
InChIKeyNAIHJJRGOAEPRB-UHFFFAOYSA-N
MW220.25 g/mol
LogP-0.29
Rot. Bonds4

About 3-trimethoxysilyloxolane-2,5-dione

3-trimethoxysilyloxolane-2,5-dione (PubChem CID 15738366) has the molecular formula C7H12O6Si and a molecular weight of 220.25 g/mol. Its IUPAC name is 3-trimethoxysilyloxolane-2,5-dione.

Molecular Properties

Compound Name3-trimethoxysilyloxolane-2,5-dione
PubChem CID15738366
Molecular FormulaC7H12O6Si
Molecular Weight220.25 g/mol
Exact Mass220.04
IUPAC Name3-trimethoxysilyloxolane-2,5-dione
SMILESCO[Si](OC)(OC)C1CC(=O)OC1=O
InChIInChI=1S/C7H12O6Si/c1-10-14(11-2,12-3)5-4-6(8)13-7(5)9/h5H,4H2,1-3H3
InChIKeyNAIHJJRGOAEPRB-UHFFFAOYSA-N
XLogP-0.29
TPSA71.06 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.25
LogP ≤ 5-0.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-trimethoxysilyloxolane-2,5-dione?
The IUPAC name of 3-trimethoxysilyloxolane-2,5-dione (CID 15738366) is 3-trimethoxysilyloxolane-2,5-dione.
What is the SMILES notation for 3-trimethoxysilyloxolane-2,5-dione?
The canonical SMILES for 3-trimethoxysilyloxolane-2,5-dione is CO[Si](OC)(OC)C1CC(=O)OC1=O.
What is the InChIKey of 3-trimethoxysilyloxolane-2,5-dione?
The InChIKey is NAIHJJRGOAEPRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12O6Si/c1-10-14(11-2,12-3)5-4-6(8)13-7(5)9/h5H,4H2,1-3H3.
What are the key properties of 3-trimethoxysilyloxolane-2,5-dione?
3-trimethoxysilyloxolane-2,5-dione has a molecular weight of 220.25 g/mol, XLogP of -0.29, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-trimethoxysilyloxolane-2,5-dione is sourced from PubChem (CID 15738366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).