[2-[(E)-2-[2,5-bis(trimethylsilyl)phenyl]ethenyl]-4-trimethylsilylphenyl]-trimethylsilane

C26H44Si4 — CID 101013161

IUPAC[2-[(E)-2-[2,5-bis(trimethylsilyl)phenyl]ethenyl]-4-trimethylsilylphenyl]-trimethylsilane
SMILESC[Si](C)(C)c1ccc([Si](C)(C)C)c(/C=C/c2cc([Si](C)(C)C)ccc2[Si](C)(C)C)c1
InChIInChI=1S/C26H44Si4/c1-27(2,3)23-15-17-25(29(7,8)9)21(19-23)13-14-22-20-24(28(4,5)6)16-18-26(22)30(10,11)12/h13-20H,1-12H3/b14-13+
InChIKeyQOMYDVKCAUPTFI-BUHFOSPRSA-N
MW468.98 g/mol
LogP6.04
Rot. Bonds6

About [2-[(E)-2-[2,5-bis(trimethylsilyl)phenyl]ethenyl]-4-trimethylsilylphenyl]-trimethylsilane

[2-[(E)-2-[2,5-bis(trimethylsilyl)phenyl]ethenyl]-4-trimethylsilylphenyl]-trimethylsilane (PubChem CID 101013161) has the molecular formula C26H44Si4 and a molecular weight of 468.98 g/mol. Its IUPAC name is [2-[(E)-2-[2,5-bis(trimethylsilyl)phenyl]ethenyl]-4-trimethylsilylphenyl]-trimethylsilane.

Molecular Properties

Compound Name[2-[(E)-2-[2,5-bis(trimethylsilyl)phenyl]ethenyl]-4-trimethylsilylphenyl]-trimethylsilane
PubChem CID101013161
Molecular FormulaC26H44Si4
Molecular Weight468.98 g/mol
Exact Mass468.25
IUPAC Name[2-[(E)-2-[2,5-bis(trimethylsilyl)phenyl]ethenyl]-4-trimethylsilylphenyl]-trimethylsilane
SMILESC[Si](C)(C)c1ccc([Si](C)(C)C)c(/C=C/c2cc([Si](C)(C)C)ccc2[Si](C)(C)C)c1
InChIInChI=1S/C26H44Si4/c1-27(2,3)23-15-17-25(29(7,8)9)21(19-23)13-14-22-20-24(28(4,5)6)16-18-26(22)30(10,11)12/h13-20H,1-12H3/b14-13+
InChIKeyQOMYDVKCAUPTFI-BUHFOSPRSA-N
XLogP6.04
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500468.98
LogP ≤ 56.04
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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Frequently Asked Questions

What is the IUPAC name of [2-[(E)-2-[2,5-bis(trimethylsilyl)phenyl]ethenyl]-4-trimethylsilylphenyl]-trimethylsilane?
The IUPAC name of [2-[(E)-2-[2,5-bis(trimethylsilyl)phenyl]ethenyl]-4-trimethylsilylphenyl]-trimethylsilane (CID 101013161) is [2-[(E)-2-[2,5-bis(trimethylsilyl)phenyl]ethenyl]-4-trimethylsilylphenyl]-trimethylsilane.
What is the SMILES notation for [2-[(E)-2-[2,5-bis(trimethylsilyl)phenyl]ethenyl]-4-trimethylsilylphenyl]-trimethylsilane?
The canonical SMILES for [2-[(E)-2-[2,5-bis(trimethylsilyl)phenyl]ethenyl]-4-trimethylsilylphenyl]-trimethylsilane is C[Si](C)(C)c1ccc([Si](C)(C)C)c(/C=C/c2cc([Si](C)(C)C)ccc2[Si](C)(C)C)c1.
What is the InChIKey of [2-[(E)-2-[2,5-bis(trimethylsilyl)phenyl]ethenyl]-4-trimethylsilylphenyl]-trimethylsilane?
The InChIKey is QOMYDVKCAUPTFI-BUHFOSPRSA-N. The full InChI is InChI=1S/C26H44Si4/c1-27(2,3)23-15-17-25(29(7,8)9)21(19-23)13-14-22-20-24(28(4,5)6)16-18-26(22)30(10,11)12/h13-20H,1-12H3/b14-13+.
What are the key properties of [2-[(E)-2-[2,5-bis(trimethylsilyl)phenyl]ethenyl]-4-trimethylsilylphenyl]-trimethylsilane?
[2-[(E)-2-[2,5-bis(trimethylsilyl)phenyl]ethenyl]-4-trimethylsilylphenyl]-trimethylsilane has a molecular weight of 468.98 g/mol, XLogP of 6.04, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(E)-2-[2,5-bis(trimethylsilyl)phenyl]ethenyl]-4-trimethylsilylphenyl]-trimethylsilane is sourced from PubChem (CID 101013161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).