4-trimethylsilyl-1,3,6,6a-tetrahydrocyclopenta[c]furan-5-one

C10H16O2Si — CID 10997938

IUPAC4-trimethylsilyl-1,3,6,6a-tetrahydrocyclopenta[c]furan-5-one
SMILESC[Si](C)(C)C1=C2COCC2CC1=O
InChIInChI=1S/C10H16O2Si/c1-13(2,3)10-8-6-12-5-7(8)4-9(10)11/h7H,4-6H2,1-3H3
InChIKeyLJGRJEQNZBPUOO-UHFFFAOYSA-N
MW196.32 g/mol
LogP1.78
Rot. Bonds1

About 4-trimethylsilyl-1,3,6,6a-tetrahydrocyclopenta[c]furan-5-one

4-trimethylsilyl-1,3,6,6a-tetrahydrocyclopenta[c]furan-5-one (PubChem CID 10997938) has the molecular formula C10H16O2Si and a molecular weight of 196.32 g/mol. Its IUPAC name is 4-trimethylsilyl-1,3,6,6a-tetrahydrocyclopenta[c]furan-5-one.

Molecular Properties

Compound Name4-trimethylsilyl-1,3,6,6a-tetrahydrocyclopenta[c]furan-5-one
PubChem CID10997938
Molecular FormulaC10H16O2Si
Molecular Weight196.32 g/mol
Exact Mass196.09
IUPAC Name4-trimethylsilyl-1,3,6,6a-tetrahydrocyclopenta[c]furan-5-one
SMILESC[Si](C)(C)C1=C2COCC2CC1=O
InChIInChI=1S/C10H16O2Si/c1-13(2,3)10-8-6-12-5-7(8)4-9(10)11/h7H,4-6H2,1-3H3
InChIKeyLJGRJEQNZBPUOO-UHFFFAOYSA-N
XLogP1.78
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.32
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 4-trimethylsilyl-1,3,6,6a-tetrahydrocyclopenta[c]furan-5-one?
The IUPAC name of 4-trimethylsilyl-1,3,6,6a-tetrahydrocyclopenta[c]furan-5-one (CID 10997938) is 4-trimethylsilyl-1,3,6,6a-tetrahydrocyclopenta[c]furan-5-one.
What is the SMILES notation for 4-trimethylsilyl-1,3,6,6a-tetrahydrocyclopenta[c]furan-5-one?
The canonical SMILES for 4-trimethylsilyl-1,3,6,6a-tetrahydrocyclopenta[c]furan-5-one is C[Si](C)(C)C1=C2COCC2CC1=O.
What is the InChIKey of 4-trimethylsilyl-1,3,6,6a-tetrahydrocyclopenta[c]furan-5-one?
The InChIKey is LJGRJEQNZBPUOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O2Si/c1-13(2,3)10-8-6-12-5-7(8)4-9(10)11/h7H,4-6H2,1-3H3.
What are the key properties of 4-trimethylsilyl-1,3,6,6a-tetrahydrocyclopenta[c]furan-5-one?
4-trimethylsilyl-1,3,6,6a-tetrahydrocyclopenta[c]furan-5-one has a molecular weight of 196.32 g/mol, XLogP of 1.78, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-trimethylsilyl-1,3,6,6a-tetrahydrocyclopenta[c]furan-5-one is sourced from PubChem (CID 10997938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).