3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-triethylsilyloxyphenol

C20H26O3Si — CID 164617265

IUPAC3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-triethylsilyloxyphenol
SMILESCC[Si](CC)(CC)Oc1cc(O)cc(/C=C/c2ccc(O)cc2)c1
InChIInChI=1S/C20H26O3Si/c1-4-24(5-2,6-3)23-20-14-17(13-19(22)15-20)8-7-16-9-11-18(21)12-10-16/h7-15,21-22H,4-6H2,1-3H3/b8-7+
InChIKeyWHUZMYJCJSIEJB-BQYQJAHWSA-N
MW342.51 g/mol
LogP5.65
Rot. Bonds7

About 3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-triethylsilyloxyphenol

3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-triethylsilyloxyphenol (PubChem CID 164617265) has the molecular formula C20H26O3Si and a molecular weight of 342.51 g/mol. Its IUPAC name is 3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-triethylsilyloxyphenol.

Molecular Properties

Compound Name3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-triethylsilyloxyphenol
PubChem CID164617265
Molecular FormulaC20H26O3Si
Molecular Weight342.51 g/mol
Exact Mass342.17
IUPAC Name3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-triethylsilyloxyphenol
SMILESCC[Si](CC)(CC)Oc1cc(O)cc(/C=C/c2ccc(O)cc2)c1
InChIInChI=1S/C20H26O3Si/c1-4-24(5-2,6-3)23-20-14-17(13-19(22)15-20)8-7-16-9-11-18(21)12-10-16/h7-15,21-22H,4-6H2,1-3H3/b8-7+
InChIKeyWHUZMYJCJSIEJB-BQYQJAHWSA-N
XLogP5.65
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.51
LogP ≤ 55.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-triethylsilyloxyphenol?
The IUPAC name of 3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-triethylsilyloxyphenol (CID 164617265) is 3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-triethylsilyloxyphenol.
What is the SMILES notation for 3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-triethylsilyloxyphenol?
The canonical SMILES for 3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-triethylsilyloxyphenol is CC[Si](CC)(CC)Oc1cc(O)cc(/C=C/c2ccc(O)cc2)c1.
What is the InChIKey of 3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-triethylsilyloxyphenol?
The InChIKey is WHUZMYJCJSIEJB-BQYQJAHWSA-N. The full InChI is InChI=1S/C20H26O3Si/c1-4-24(5-2,6-3)23-20-14-17(13-19(22)15-20)8-7-16-9-11-18(21)12-10-16/h7-15,21-22H,4-6H2,1-3H3/b8-7+.
What are the key properties of 3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-triethylsilyloxyphenol?
3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-triethylsilyloxyphenol has a molecular weight of 342.51 g/mol, XLogP of 5.65, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-triethylsilyloxyphenol is sourced from PubChem (CID 164617265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).