[(E)-2-(benzenesulfonyl)ethenyl]-trimethylsilane

C11H16O2SSi — CID 11770575

IUPAC[(E)-2-(benzenesulfonyl)ethenyl]-trimethylsilane
SMILESC[Si](C)(C)/C=C/S(=O)(=O)c1ccccc1
InChIInChI=1S/C11H16O2SSi/c1-15(2,3)10-9-14(12,13)11-7-5-4-6-8-11/h4-10H,1-3H3/b10-9+
InChIKeyOAFHXIYOGFKWQE-MDZDMXLPSA-N
MW240.40 g/mol
LogP2.85
Rot. Bonds3

About [(E)-2-(benzenesulfonyl)ethenyl]-trimethylsilane

[(E)-2-(benzenesulfonyl)ethenyl]-trimethylsilane (PubChem CID 11770575) has the molecular formula C11H16O2SSi and a molecular weight of 240.40 g/mol. Its IUPAC name is [(E)-2-(benzenesulfonyl)ethenyl]-trimethylsilane.

Molecular Properties

Compound Name[(E)-2-(benzenesulfonyl)ethenyl]-trimethylsilane
PubChem CID11770575
Molecular FormulaC11H16O2SSi
Molecular Weight240.40 g/mol
Exact Mass240.06
IUPAC Name[(E)-2-(benzenesulfonyl)ethenyl]-trimethylsilane
SMILESC[Si](C)(C)/C=C/S(=O)(=O)c1ccccc1
InChIInChI=1S/C11H16O2SSi/c1-15(2,3)10-9-14(12,13)11-7-5-4-6-8-11/h4-10H,1-3H3/b10-9+
InChIKeyOAFHXIYOGFKWQE-MDZDMXLPSA-N
XLogP2.85
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.40
LogP ≤ 52.85
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 [(E)-2-(benzenesulfonyl)ethenyl]-trimethylsilane?
The IUPAC name of [(E)-2-(benzenesulfonyl)ethenyl]-trimethylsilane (CID 11770575) is [(E)-2-(benzenesulfonyl)ethenyl]-trimethylsilane.
What is the SMILES notation for [(E)-2-(benzenesulfonyl)ethenyl]-trimethylsilane?
The canonical SMILES for [(E)-2-(benzenesulfonyl)ethenyl]-trimethylsilane is C[Si](C)(C)/C=C/S(=O)(=O)c1ccccc1.
What is the InChIKey of [(E)-2-(benzenesulfonyl)ethenyl]-trimethylsilane?
The InChIKey is OAFHXIYOGFKWQE-MDZDMXLPSA-N. The full InChI is InChI=1S/C11H16O2SSi/c1-15(2,3)10-9-14(12,13)11-7-5-4-6-8-11/h4-10H,1-3H3/b10-9+.
What are the key properties of [(E)-2-(benzenesulfonyl)ethenyl]-trimethylsilane?
[(E)-2-(benzenesulfonyl)ethenyl]-trimethylsilane has a molecular weight of 240.40 g/mol, XLogP of 2.85, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-2-(benzenesulfonyl)ethenyl]-trimethylsilane is sourced from PubChem (CID 11770575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).