[2-(benzenesulfonyl)oxiran-2-yl]-trimethylsilane

C11H16O3SSi — CID 14027014

IUPAC[2-(benzenesulfonyl)oxiran-2-yl]-trimethylsilane
SMILESC[Si](C)(C)C1(S(=O)(=O)c2ccccc2)CO1
InChIInChI=1S/C11H16O3SSi/c1-16(2,3)11(9-14-11)15(12,13)10-7-5-4-6-8-10/h4-8H,9H2,1-3H3
InChIKeyZOMOZOMSFKXLRS-UHFFFAOYSA-N
MW256.40 g/mol
LogP2.06
Rot. Bonds3

About [2-(benzenesulfonyl)oxiran-2-yl]-trimethylsilane

[2-(benzenesulfonyl)oxiran-2-yl]-trimethylsilane (PubChem CID 14027014) has the molecular formula C11H16O3SSi and a molecular weight of 256.40 g/mol. Its IUPAC name is [2-(benzenesulfonyl)oxiran-2-yl]-trimethylsilane.

Molecular Properties

Compound Name[2-(benzenesulfonyl)oxiran-2-yl]-trimethylsilane
PubChem CID14027014
Molecular FormulaC11H16O3SSi
Molecular Weight256.40 g/mol
Exact Mass256.06
IUPAC Name[2-(benzenesulfonyl)oxiran-2-yl]-trimethylsilane
SMILESC[Si](C)(C)C1(S(=O)(=O)c2ccccc2)CO1
InChIInChI=1S/C11H16O3SSi/c1-16(2,3)11(9-14-11)15(12,13)10-7-5-4-6-8-10/h4-8H,9H2,1-3H3
InChIKeyZOMOZOMSFKXLRS-UHFFFAOYSA-N
XLogP2.06
TPSA46.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.40
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

Phenyl Trimethylsilylmethyl Sulfone
CID 3290840
2-(2-(Phenylsulfonyl)ethyl)oxirane
CID 11356304
2-[(Phenylsulfonyl)methyl]oxirane
CID 11356071
2-Ethoxyethylsulfonylbenzene
CID 44377531
2-(Benzenesulfonyl)-3-propyloxirane
CID 14532897
[(E)-2-(benzenesulfonyl)-2-fluoroethenyl]-trimethylsilane
CID 134875849
AG-G-90643
CID 2724975
Silane, trimethyl[(phenylsulfonyl)ethynyl]-
CID 4183962
[(E)-2-(benzenesulfonyl)ethenyl]-trimethylsilane
CID 11770575
(3,3-Difluoro-3-(phenylsulfonyl)propyl)trimethylsilane
CID 16744214
[(E)-1-(benzenesulfonyl)-1-fluoroprop-1-en-2-yl]-trimethylsilane
CID 134879679
tert-Butyl o-trimethylsilylphenyl sulfone
CID 546648

Frequently Asked Questions

What is the IUPAC name of [2-(benzenesulfonyl)oxiran-2-yl]-trimethylsilane?
The IUPAC name of [2-(benzenesulfonyl)oxiran-2-yl]-trimethylsilane (CID 14027014) is [2-(benzenesulfonyl)oxiran-2-yl]-trimethylsilane.
What is the SMILES notation for [2-(benzenesulfonyl)oxiran-2-yl]-trimethylsilane?
The canonical SMILES for [2-(benzenesulfonyl)oxiran-2-yl]-trimethylsilane is C[Si](C)(C)C1(S(=O)(=O)c2ccccc2)CO1.
What is the InChIKey of [2-(benzenesulfonyl)oxiran-2-yl]-trimethylsilane?
The InChIKey is ZOMOZOMSFKXLRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O3SSi/c1-16(2,3)11(9-14-11)15(12,13)10-7-5-4-6-8-10/h4-8H,9H2,1-3H3.
What are the key properties of [2-(benzenesulfonyl)oxiran-2-yl]-trimethylsilane?
[2-(benzenesulfonyl)oxiran-2-yl]-trimethylsilane has a molecular weight of 256.40 g/mol, XLogP of 2.06, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(benzenesulfonyl)oxiran-2-yl]-trimethylsilane is sourced from PubChem (CID 14027014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).