3-(2-trimethylsilylpropyl)oxolane-2,5-dione

C10H18O3Si — CID 59938370

IUPAC3-(2-trimethylsilylpropyl)oxolane-2,5-dione
SMILESCC(CC1CC(=O)OC1=O)[Si](C)(C)C
InChIInChI=1S/C10H18O3Si/c1-7(14(2,3)4)5-8-6-9(11)13-10(8)12/h7-8H,5-6H2,1-4H3
InChIKeyPRXIXASSQHDXNV-UHFFFAOYSA-N
MW214.34 g/mol
LogP2.19
Rot. Bonds3

About 3-(2-trimethylsilylpropyl)oxolane-2,5-dione

3-(2-trimethylsilylpropyl)oxolane-2,5-dione (PubChem CID 59938370) has the molecular formula C10H18O3Si and a molecular weight of 214.34 g/mol. Its IUPAC name is 3-(2-trimethylsilylpropyl)oxolane-2,5-dione.

Molecular Properties

Compound Name3-(2-trimethylsilylpropyl)oxolane-2,5-dione
PubChem CID59938370
Molecular FormulaC10H18O3Si
Molecular Weight214.34 g/mol
Exact Mass214.10
IUPAC Name3-(2-trimethylsilylpropyl)oxolane-2,5-dione
SMILESCC(CC1CC(=O)OC1=O)[Si](C)(C)C
InChIInChI=1S/C10H18O3Si/c1-7(14(2,3)4)5-8-6-9(11)13-10(8)12/h7-8H,5-6H2,1-4H3
InChIKeyPRXIXASSQHDXNV-UHFFFAOYSA-N
XLogP2.19
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.34
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-[[(3S)-2,5-dioxooxolan-3-yl]methyl]oxolane-2,5-dione
CID 148818763
3-(2-hexyldecyl)oxolane-2,5-dione
CID 90097441
3-[4-[dimethoxy(methyl)silyl]but-2-enyl]oxolane-2,5-dione
CID 123219658
ethane;3-propyloxolane-2,5-dione
CID 143734634
3-[(E)-4-[methyl(oxo)silyl]but-2-enyl]oxolane-2,5-dione
CID 90159814
3-octa-2,4-dienyloxolane-2,5-dione
CID 153403981
3-[7-(2,5-dioxooxolan-3-yl)heptyl]oxolane-2,5-dione
CID 59893092
3-[4-[ethoxy(dimethyl)silyl]but-2-enyl]oxolane-2,5-dione
CID 123308468
3-[(E)-2,4,6,8,10,12-hexamethyltridec-2-enyl]oxolane-2,5-dione
CID 58626891
3-(2,2,3,5-tetramethylhexyl)oxolane-2,5-dione
CID 144726424
3-[2-(methylamino)ethyl]oxolane-2,5-dione
CID 54031250
3-(2-methoxyethyl)oxolane-2,5-dione
CID 13255588

Frequently Asked Questions

What is the IUPAC name of 3-(2-trimethylsilylpropyl)oxolane-2,5-dione?
The IUPAC name of 3-(2-trimethylsilylpropyl)oxolane-2,5-dione (CID 59938370) is 3-(2-trimethylsilylpropyl)oxolane-2,5-dione.
What is the SMILES notation for 3-(2-trimethylsilylpropyl)oxolane-2,5-dione?
The canonical SMILES for 3-(2-trimethylsilylpropyl)oxolane-2,5-dione is CC(CC1CC(=O)OC1=O)[Si](C)(C)C.
What is the InChIKey of 3-(2-trimethylsilylpropyl)oxolane-2,5-dione?
The InChIKey is PRXIXASSQHDXNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O3Si/c1-7(14(2,3)4)5-8-6-9(11)13-10(8)12/h7-8H,5-6H2,1-4H3.
What are the key properties of 3-(2-trimethylsilylpropyl)oxolane-2,5-dione?
3-(2-trimethylsilylpropyl)oxolane-2,5-dione has a molecular weight of 214.34 g/mol, XLogP of 2.19, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-trimethylsilylpropyl)oxolane-2,5-dione is sourced from PubChem (CID 59938370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).