trimethyl-[2-(4-methylphenyl)sulfinylethyl]silane

C12H20OSSi — CID 23729825

IUPACtrimethyl-[2-(4-methylphenyl)sulfinylethyl]silane
SMILESCc1ccc(S(=O)CC[Si](C)(C)C)cc1
InChIInChI=1S/C12H20OSSi/c1-11-5-7-12(8-6-11)14(13)9-10-15(2,3)4/h5-8H,9-10H2,1-4H3
InChIKeyRAZLZRRZYUBFJR-UHFFFAOYSA-N
MW240.44 g/mol
LogP3.44
Rot. Bonds4

About trimethyl-[2-(4-methylphenyl)sulfinylethyl]silane

trimethyl-[2-(4-methylphenyl)sulfinylethyl]silane (PubChem CID 23729825) has the molecular formula C12H20OSSi and a molecular weight of 240.44 g/mol. Its IUPAC name is trimethyl-[2-(4-methylphenyl)sulfinylethyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-(4-methylphenyl)sulfinylethyl]silane
PubChem CID23729825
Molecular FormulaC12H20OSSi
Molecular Weight240.44 g/mol
Exact Mass240.10
IUPAC Nametrimethyl-[2-(4-methylphenyl)sulfinylethyl]silane
SMILESCc1ccc(S(=O)CC[Si](C)(C)C)cc1
InChIInChI=1S/C12H20OSSi/c1-11-5-7-12(8-6-11)14(13)9-10-15(2,3)4/h5-8H,9-10H2,1-4H3
InChIKeyRAZLZRRZYUBFJR-UHFFFAOYSA-N
XLogP3.44
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.44
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

trimethyl-[2-[(4-methylphenyl)sulfinylmethoxy]ethyl]silane
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CID 14025349
N-methyl-5-(4-methylphenyl)sulfinylpentan-2-amine
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1-[(E)-but-2-enyl]sulfinyl-4-methylbenzene
CID 15250886
1-(2,2-dimethylpropylsulfinyl)-4-methylbenzene
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2-bromo-3-[(4-methylphenyl)sulfinylmethyl]aniline
CID 114048900
6-(4-methylphenyl)sulfinylhexan-3-one
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1-methyl-4-[(S)-2-phenoxyethylsulfinyl]benzene
CID 40513050
methyl 2-[(R)-(4-methylphenyl)sulfinyl]acetate
CID 10751029

Frequently Asked Questions

What is the IUPAC name of trimethyl-[2-(4-methylphenyl)sulfinylethyl]silane?
The IUPAC name of trimethyl-[2-(4-methylphenyl)sulfinylethyl]silane (CID 23729825) is trimethyl-[2-(4-methylphenyl)sulfinylethyl]silane.
What is the SMILES notation for trimethyl-[2-(4-methylphenyl)sulfinylethyl]silane?
The canonical SMILES for trimethyl-[2-(4-methylphenyl)sulfinylethyl]silane is Cc1ccc(S(=O)CC[Si](C)(C)C)cc1.
What is the InChIKey of trimethyl-[2-(4-methylphenyl)sulfinylethyl]silane?
The InChIKey is RAZLZRRZYUBFJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20OSSi/c1-11-5-7-12(8-6-11)14(13)9-10-15(2,3)4/h5-8H,9-10H2,1-4H3.
What are the key properties of trimethyl-[2-(4-methylphenyl)sulfinylethyl]silane?
trimethyl-[2-(4-methylphenyl)sulfinylethyl]silane has a molecular weight of 240.44 g/mol, XLogP of 3.44, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-(4-methylphenyl)sulfinylethyl]silane is sourced from PubChem (CID 23729825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).