[(E)-1,2-bis[(4-fluorophenyl)sulfanyl]ethenyl]-trimethylsilane

C17H18F2S2Si — CID 46196726

IUPAC[(E)-1,2-bis[(4-fluorophenyl)sulfanyl]ethenyl]-trimethylsilane
SMILESC[Si](C)(C)/C(=C\Sc1ccc(F)cc1)Sc1ccc(F)cc1
InChIInChI=1S/C17H18F2S2Si/c1-22(2,3)17(21-16-10-6-14(19)7-11-16)12-20-15-8-4-13(18)5-9-15/h4-12H,1-3H3/b17-12-
InChIKeyARFHNFRNSLTJDP-ATVHPVEESA-N
MW352.55 g/mol
LogP6.57
Rot. Bonds5

About [(E)-1,2-bis[(4-fluorophenyl)sulfanyl]ethenyl]-trimethylsilane

[(E)-1,2-bis[(4-fluorophenyl)sulfanyl]ethenyl]-trimethylsilane (PubChem CID 46196726) has the molecular formula C17H18F2S2Si and a molecular weight of 352.55 g/mol. Its IUPAC name is [(E)-1,2-bis[(4-fluorophenyl)sulfanyl]ethenyl]-trimethylsilane.

Molecular Properties

Compound Name[(E)-1,2-bis[(4-fluorophenyl)sulfanyl]ethenyl]-trimethylsilane
PubChem CID46196726
Molecular FormulaC17H18F2S2Si
Molecular Weight352.55 g/mol
Exact Mass352.06
IUPAC Name[(E)-1,2-bis[(4-fluorophenyl)sulfanyl]ethenyl]-trimethylsilane
SMILESC[Si](C)(C)/C(=C\Sc1ccc(F)cc1)Sc1ccc(F)cc1
InChIInChI=1S/C17H18F2S2Si/c1-22(2,3)17(21-16-10-6-14(19)7-11-16)12-20-15-8-4-13(18)5-9-15/h4-12H,1-3H3/b17-12-
InChIKeyARFHNFRNSLTJDP-ATVHPVEESA-N
XLogP6.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.55
LogP ≤ 56.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(Difluoro(phenylthio)methyl)trimethylsilane
CID 11075297
1,2-Bis((4-fluorophenyl)thio)ethane
CID 12261865
1,1'-[Methylenebis(thio)]bis[4-fluorobenzene]
CID 12261871
1,4-Bis(phenylthio)-2-butene
CID 5373859
Benzene, 1,1'-[butylidenebis(thio)]bis-
CID 10989463
[(4-Fluorophenylthio)methylthio]benzene
CID 717456
Silane, trimethyl(4-(methylthio)phenyl)-
CID 140932
4-Phenylsulfanylbutylsulfanylbenzene
CID 220179
Phenyl (E)-2-(trimethylsilyl)ethenyl sulfide
CID 11138322
Trimethyl[1-(phenylsulfanyl)prop-2-en-1-yl]silane
CID 12677743
Trimethyl(2-(phenylthio)-1,3-dithian-2-yl)silane
CID 361793
Bis(beta-phenyl-mercaptoethyl) sulfide
CID 314365

Frequently Asked Questions

What is the IUPAC name of [(E)-1,2-bis[(4-fluorophenyl)sulfanyl]ethenyl]-trimethylsilane?
The IUPAC name of [(E)-1,2-bis[(4-fluorophenyl)sulfanyl]ethenyl]-trimethylsilane (CID 46196726) is [(E)-1,2-bis[(4-fluorophenyl)sulfanyl]ethenyl]-trimethylsilane.
What is the SMILES notation for [(E)-1,2-bis[(4-fluorophenyl)sulfanyl]ethenyl]-trimethylsilane?
The canonical SMILES for [(E)-1,2-bis[(4-fluorophenyl)sulfanyl]ethenyl]-trimethylsilane is C[Si](C)(C)/C(=C\Sc1ccc(F)cc1)Sc1ccc(F)cc1.
What is the InChIKey of [(E)-1,2-bis[(4-fluorophenyl)sulfanyl]ethenyl]-trimethylsilane?
The InChIKey is ARFHNFRNSLTJDP-ATVHPVEESA-N. The full InChI is InChI=1S/C17H18F2S2Si/c1-22(2,3)17(21-16-10-6-14(19)7-11-16)12-20-15-8-4-13(18)5-9-15/h4-12H,1-3H3/b17-12-.
What are the key properties of [(E)-1,2-bis[(4-fluorophenyl)sulfanyl]ethenyl]-trimethylsilane?
[(E)-1,2-bis[(4-fluorophenyl)sulfanyl]ethenyl]-trimethylsilane has a molecular weight of 352.55 g/mol, XLogP of 6.57, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-1,2-bis[(4-fluorophenyl)sulfanyl]ethenyl]-trimethylsilane is sourced from PubChem (CID 46196726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).