4,6-bis(trimethylsilyl)-2,3-dihydrocyclopenta[b]furan-5-one

C13H22O2Si2 — CID 15505232

IUPAC4,6-bis(trimethylsilyl)-2,3-dihydrocyclopenta[b]furan-5-one
SMILESC[Si](C)(C)C1=C2CCOC2=C([Si](C)(C)C)C1=O
InChIInChI=1S/C13H22O2Si2/c1-16(2,3)12-9-7-8-15-11(9)13(10(12)14)17(4,5)6/h7-8H2,1-6H3
InChIKeyRRESLVRGQNKFCW-UHFFFAOYSA-N
MW266.49 g/mol
LogP3.29
Rot. Bonds2

About 4,6-bis(trimethylsilyl)-2,3-dihydrocyclopenta[b]furan-5-one

4,6-bis(trimethylsilyl)-2,3-dihydrocyclopenta[b]furan-5-one (PubChem CID 15505232) has the molecular formula C13H22O2Si2 and a molecular weight of 266.49 g/mol. Its IUPAC name is 4,6-bis(trimethylsilyl)-2,3-dihydrocyclopenta[b]furan-5-one.

Molecular Properties

Compound Name4,6-bis(trimethylsilyl)-2,3-dihydrocyclopenta[b]furan-5-one
PubChem CID15505232
Molecular FormulaC13H22O2Si2
Molecular Weight266.49 g/mol
Exact Mass266.12
IUPAC Name4,6-bis(trimethylsilyl)-2,3-dihydrocyclopenta[b]furan-5-one
SMILESC[Si](C)(C)C1=C2CCOC2=C([Si](C)(C)C)C1=O
InChIInChI=1S/C13H22O2Si2/c1-16(2,3)12-9-7-8-15-11(9)13(10(12)14)17(4,5)6/h7-8H2,1-6H3
InChIKeyRRESLVRGQNKFCW-UHFFFAOYSA-N
XLogP3.29
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.49
LogP ≤ 53.29
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 4,6-bis(trimethylsilyl)-2,3-dihydrocyclopenta[b]furan-5-one?
The IUPAC name of 4,6-bis(trimethylsilyl)-2,3-dihydrocyclopenta[b]furan-5-one (CID 15505232) is 4,6-bis(trimethylsilyl)-2,3-dihydrocyclopenta[b]furan-5-one.
What is the SMILES notation for 4,6-bis(trimethylsilyl)-2,3-dihydrocyclopenta[b]furan-5-one?
The canonical SMILES for 4,6-bis(trimethylsilyl)-2,3-dihydrocyclopenta[b]furan-5-one is C[Si](C)(C)C1=C2CCOC2=C([Si](C)(C)C)C1=O.
What is the InChIKey of 4,6-bis(trimethylsilyl)-2,3-dihydrocyclopenta[b]furan-5-one?
The InChIKey is RRESLVRGQNKFCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22O2Si2/c1-16(2,3)12-9-7-8-15-11(9)13(10(12)14)17(4,5)6/h7-8H2,1-6H3.
What are the key properties of 4,6-bis(trimethylsilyl)-2,3-dihydrocyclopenta[b]furan-5-one?
4,6-bis(trimethylsilyl)-2,3-dihydrocyclopenta[b]furan-5-one has a molecular weight of 266.49 g/mol, XLogP of 3.29, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-bis(trimethylsilyl)-2,3-dihydrocyclopenta[b]furan-5-one is sourced from PubChem (CID 15505232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).