3-trimethylsilylcyclopent-2-en-1-one

C8H14OSi — CID 12617880

IUPAC3-trimethylsilylcyclopent-2-en-1-one
SMILESC[Si](C)(C)C1=CC(=O)CC1
InChIInChI=1S/C8H14OSi/c1-10(2,3)8-5-4-7(9)6-8/h6H,4-5H2,1-3H3
InChIKeyUKBSNTRHDPNLFO-UHFFFAOYSA-N
MW154.28 g/mol
LogP2.15
Rot. Bonds1

About 3-trimethylsilylcyclopent-2-en-1-one

3-trimethylsilylcyclopent-2-en-1-one (PubChem CID 12617880) has the molecular formula C8H14OSi and a molecular weight of 154.28 g/mol. Its IUPAC name is 3-trimethylsilylcyclopent-2-en-1-one.

Molecular Properties

Compound Name3-trimethylsilylcyclopent-2-en-1-one
PubChem CID12617880
Molecular FormulaC8H14OSi
Molecular Weight154.28 g/mol
Exact Mass154.08
IUPAC Name3-trimethylsilylcyclopent-2-en-1-one
SMILESC[Si](C)(C)C1=CC(=O)CC1
InChIInChI=1S/C8H14OSi/c1-10(2,3)8-5-4-7(9)6-8/h6H,4-5H2,1-3H3
InChIKeyUKBSNTRHDPNLFO-UHFFFAOYSA-N
XLogP2.15
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.28
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 3-trimethylsilylcyclopent-2-en-1-one?
The IUPAC name of 3-trimethylsilylcyclopent-2-en-1-one (CID 12617880) is 3-trimethylsilylcyclopent-2-en-1-one.
What is the SMILES notation for 3-trimethylsilylcyclopent-2-en-1-one?
The canonical SMILES for 3-trimethylsilylcyclopent-2-en-1-one is C[Si](C)(C)C1=CC(=O)CC1.
What is the InChIKey of 3-trimethylsilylcyclopent-2-en-1-one?
The InChIKey is UKBSNTRHDPNLFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14OSi/c1-10(2,3)8-5-4-7(9)6-8/h6H,4-5H2,1-3H3.
What are the key properties of 3-trimethylsilylcyclopent-2-en-1-one?
3-trimethylsilylcyclopent-2-en-1-one has a molecular weight of 154.28 g/mol, XLogP of 2.15, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-trimethylsilylcyclopent-2-en-1-one is sourced from PubChem (CID 12617880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).