bis[4-[2-(4-ethylphenyl)ethenyl]phenyl]-dimethylsilane

C34H36Si — CID 72543241

IUPACbis[4-[2-(4-ethylphenyl)ethenyl]phenyl]-dimethylsilane
SMILESCCc1ccc(C=Cc2ccc([Si](C)(C)c3ccc(C=Cc4ccc(CC)cc4)cc3)cc2)cc1
InChIInChI=1S/C34H36Si/c1-5-27-7-11-29(12-8-27)15-17-31-19-23-33(24-20-31)35(3,4)34-25-21-32(22-26-34)18-16-30-13-9-28(6-2)10-14-30/h7-26H,5-6H2,1-4H3
InChIKeyJCXMWPNWQAYLKI-UHFFFAOYSA-N
MW472.75 g/mol
LogP7.97
Rot. Bonds8

About bis[4-[2-(4-ethylphenyl)ethenyl]phenyl]-dimethylsilane

bis[4-[2-(4-ethylphenyl)ethenyl]phenyl]-dimethylsilane (PubChem CID 72543241) has the molecular formula C34H36Si and a molecular weight of 472.75 g/mol. Its IUPAC name is bis[4-[2-(4-ethylphenyl)ethenyl]phenyl]-dimethylsilane.

Molecular Properties

Compound Namebis[4-[2-(4-ethylphenyl)ethenyl]phenyl]-dimethylsilane
PubChem CID72543241
Molecular FormulaC34H36Si
Molecular Weight472.75 g/mol
Exact Mass472.26
IUPAC Namebis[4-[2-(4-ethylphenyl)ethenyl]phenyl]-dimethylsilane
SMILESCCc1ccc(C=Cc2ccc([Si](C)(C)c3ccc(C=Cc4ccc(CC)cc4)cc3)cc2)cc1
InChIInChI=1S/C34H36Si/c1-5-27-7-11-29(12-8-27)15-17-31-19-23-33(24-20-31)35(3,4)34-25-21-32(22-26-34)18-16-30-13-9-28(6-2)10-14-30/h7-26H,5-6H2,1-4H3
InChIKeyJCXMWPNWQAYLKI-UHFFFAOYSA-N
XLogP7.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500472.75
LogP ≤ 57.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-ethyl-4-[2-[4-(trifluoromethyl)phenyl]ethenyl]benzene
CID 76576198
1-ethyl-4-[(E)-2-[4-[2-[4-[(E)-2-(4-ethylphenyl)ethenyl]phenyl]ethynyl]phenyl]ethenyl]benzene
CID 59221401
4-ethyl-N-[4-[(E)-2-[4-(N-(4-ethylphenyl)anilino)phenyl]ethenyl]phenyl]-N-phenylaniline
CID 59722336
1-ethyl-4-[(E)-2-(4-methoxyphenyl)ethenyl]benzene
CID 21449166
1-ethyl-4-[4-[4-[(E)-prop-1-enyl]phenyl]phenyl]benzene
CID 176777881
1-ethyl-4-(2-methoxyethenyl)benzene
CID 131871300
2-[(E)-2-(4-ethylphenyl)ethenyl]-1,3,5-trimethylbenzene
CID 147588244
1-ethyl-4-[(E)-2-(3-methylphenyl)ethenyl]benzene
CID 102133829
ethanamine;1-ethyl-4-[(E)-2-(4-methoxyphenyl)ethenyl]benzene
CID 159851450
bis[4-[(E)-2-(furan-2-yl)ethenyl]phenyl]-dimethylsilane
CID 177455592
1-ethyl-4-[4-[(E)-2-fluoroethenyl]phenyl]benzene
CID 19780877
(Z)-3-(4-ethylphenyl)prop-2-enenitrile
CID 56954563

Frequently Asked Questions

What is the IUPAC name of bis[4-[2-(4-ethylphenyl)ethenyl]phenyl]-dimethylsilane?
The IUPAC name of bis[4-[2-(4-ethylphenyl)ethenyl]phenyl]-dimethylsilane (CID 72543241) is bis[4-[2-(4-ethylphenyl)ethenyl]phenyl]-dimethylsilane.
What is the SMILES notation for bis[4-[2-(4-ethylphenyl)ethenyl]phenyl]-dimethylsilane?
The canonical SMILES for bis[4-[2-(4-ethylphenyl)ethenyl]phenyl]-dimethylsilane is CCc1ccc(C=Cc2ccc([Si](C)(C)c3ccc(C=Cc4ccc(CC)cc4)cc3)cc2)cc1.
What is the InChIKey of bis[4-[2-(4-ethylphenyl)ethenyl]phenyl]-dimethylsilane?
The InChIKey is JCXMWPNWQAYLKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H36Si/c1-5-27-7-11-29(12-8-27)15-17-31-19-23-33(24-20-31)35(3,4)34-25-21-32(22-26-34)18-16-30-13-9-28(6-2)10-14-30/h7-26H,5-6H2,1-4H3.
What are the key properties of bis[4-[2-(4-ethylphenyl)ethenyl]phenyl]-dimethylsilane?
bis[4-[2-(4-ethylphenyl)ethenyl]phenyl]-dimethylsilane has a molecular weight of 472.75 g/mol, XLogP of 7.97, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis[4-[2-(4-ethylphenyl)ethenyl]phenyl]-dimethylsilane is sourced from PubChem (CID 72543241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).