trimethyl-[(E)-2-[(R)-(4-methylphenyl)sulfinyl]ethenyl]silane

C12H18OSSi — CID 10900705

IUPACtrimethyl-[(E)-2-[(R)-(4-methylphenyl)sulfinyl]ethenyl]silane
SMILESCc1ccc([S@](=O)/C=C/[Si](C)(C)C)cc1
InChIInChI=1S/C12H18OSSi/c1-11-5-7-12(8-6-11)14(13)9-10-15(2,3)4/h5-10H,1-4H3/b10-9+/t14-/m1/s1
InChIKeyWUPCCVDJGWUWFS-ATWMFIQVSA-N
MW238.43 g/mol
LogP3.49
Rot. Bonds3

About trimethyl-[(E)-2-[(R)-(4-methylphenyl)sulfinyl]ethenyl]silane

trimethyl-[(E)-2-[(R)-(4-methylphenyl)sulfinyl]ethenyl]silane (PubChem CID 10900705) has the molecular formula C12H18OSSi and a molecular weight of 238.43 g/mol. Its IUPAC name is trimethyl-[(E)-2-[(R)-(4-methylphenyl)sulfinyl]ethenyl]silane.

Molecular Properties

Compound Nametrimethyl-[(E)-2-[(R)-(4-methylphenyl)sulfinyl]ethenyl]silane
PubChem CID10900705
Molecular FormulaC12H18OSSi
Molecular Weight238.43 g/mol
Exact Mass238.08
IUPAC Nametrimethyl-[(E)-2-[(R)-(4-methylphenyl)sulfinyl]ethenyl]silane
SMILESCc1ccc([S@](=O)/C=C/[Si](C)(C)C)cc1
InChIInChI=1S/C12H18OSSi/c1-11-5-7-12(8-6-11)14(13)9-10-15(2,3)4/h5-10H,1-4H3/b10-9+/t14-/m1/s1
InChIKeyWUPCCVDJGWUWFS-ATWMFIQVSA-N
XLogP3.49
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.43
LogP ≤ 53.49
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 trimethyl-[(E)-2-[(R)-(4-methylphenyl)sulfinyl]ethenyl]silane?
The IUPAC name of trimethyl-[(E)-2-[(R)-(4-methylphenyl)sulfinyl]ethenyl]silane (CID 10900705) is trimethyl-[(E)-2-[(R)-(4-methylphenyl)sulfinyl]ethenyl]silane.
What is the SMILES notation for trimethyl-[(E)-2-[(R)-(4-methylphenyl)sulfinyl]ethenyl]silane?
The canonical SMILES for trimethyl-[(E)-2-[(R)-(4-methylphenyl)sulfinyl]ethenyl]silane is Cc1ccc([S@](=O)/C=C/[Si](C)(C)C)cc1.
What is the InChIKey of trimethyl-[(E)-2-[(R)-(4-methylphenyl)sulfinyl]ethenyl]silane?
The InChIKey is WUPCCVDJGWUWFS-ATWMFIQVSA-N. The full InChI is InChI=1S/C12H18OSSi/c1-11-5-7-12(8-6-11)14(13)9-10-15(2,3)4/h5-10H,1-4H3/b10-9+/t14-/m1/s1.
What are the key properties of trimethyl-[(E)-2-[(R)-(4-methylphenyl)sulfinyl]ethenyl]silane?
trimethyl-[(E)-2-[(R)-(4-methylphenyl)sulfinyl]ethenyl]silane has a molecular weight of 238.43 g/mol, XLogP of 3.49, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(E)-2-[(R)-(4-methylphenyl)sulfinyl]ethenyl]silane is sourced from PubChem (CID 10900705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).