[(1E,4E)-1,5-diphenyl-3-(trifluoromethyl)penta-1,4-dien-3-yl]oxy-trimethylsilane

C21H23F3OSi — CID 10714568

IUPAC[(1E,4E)-1,5-diphenyl-3-(trifluoromethyl)penta-1,4-dien-3-yl]oxy-trimethylsilane
SMILESC[Si](C)(C)OC(/C=C/c1ccccc1)(/C=C/c1ccccc1)C(F)(F)F
InChIInChI=1S/C21H23F3OSi/c1-26(2,3)25-20(21(22,23)24,16-14-18-10-6-4-7-11-18)17-15-19-12-8-5-9-13-19/h4-17H,1-3H3/b16-14+,17-15+
InChIKeyUOWJHFQISDAHEA-YXLFCKQPSA-N
MW376.49 g/mol
LogP6.57
Rot. Bonds6

About [(1E,4E)-1,5-diphenyl-3-(trifluoromethyl)penta-1,4-dien-3-yl]oxy-trimethylsilane

[(1E,4E)-1,5-diphenyl-3-(trifluoromethyl)penta-1,4-dien-3-yl]oxy-trimethylsilane (PubChem CID 10714568) has the molecular formula C21H23F3OSi and a molecular weight of 376.49 g/mol. Its IUPAC name is [(1E,4E)-1,5-diphenyl-3-(trifluoromethyl)penta-1,4-dien-3-yl]oxy-trimethylsilane.

Molecular Properties

Compound Name[(1E,4E)-1,5-diphenyl-3-(trifluoromethyl)penta-1,4-dien-3-yl]oxy-trimethylsilane
PubChem CID10714568
Molecular FormulaC21H23F3OSi
Molecular Weight376.49 g/mol
Exact Mass376.15
IUPAC Name[(1E,4E)-1,5-diphenyl-3-(trifluoromethyl)penta-1,4-dien-3-yl]oxy-trimethylsilane
SMILESC[Si](C)(C)OC(/C=C/c1ccccc1)(/C=C/c1ccccc1)C(F)(F)F
InChIInChI=1S/C21H23F3OSi/c1-26(2,3)25-20(21(22,23)24,16-14-18-10-6-4-7-11-18)17-15-19-12-8-5-9-13-19/h4-17H,1-3H3/b16-14+,17-15+
InChIKeyUOWJHFQISDAHEA-YXLFCKQPSA-N
XLogP6.57
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.49
LogP ≤ 56.57
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 [(1E,4E)-1,5-diphenyl-3-(trifluoromethyl)penta-1,4-dien-3-yl]oxy-trimethylsilane?
The IUPAC name of [(1E,4E)-1,5-diphenyl-3-(trifluoromethyl)penta-1,4-dien-3-yl]oxy-trimethylsilane (CID 10714568) is [(1E,4E)-1,5-diphenyl-3-(trifluoromethyl)penta-1,4-dien-3-yl]oxy-trimethylsilane.
What is the SMILES notation for [(1E,4E)-1,5-diphenyl-3-(trifluoromethyl)penta-1,4-dien-3-yl]oxy-trimethylsilane?
The canonical SMILES for [(1E,4E)-1,5-diphenyl-3-(trifluoromethyl)penta-1,4-dien-3-yl]oxy-trimethylsilane is C[Si](C)(C)OC(/C=C/c1ccccc1)(/C=C/c1ccccc1)C(F)(F)F.
What is the InChIKey of [(1E,4E)-1,5-diphenyl-3-(trifluoromethyl)penta-1,4-dien-3-yl]oxy-trimethylsilane?
The InChIKey is UOWJHFQISDAHEA-YXLFCKQPSA-N. The full InChI is InChI=1S/C21H23F3OSi/c1-26(2,3)25-20(21(22,23)24,16-14-18-10-6-4-7-11-18)17-15-19-12-8-5-9-13-19/h4-17H,1-3H3/b16-14+,17-15+.
What are the key properties of [(1E,4E)-1,5-diphenyl-3-(trifluoromethyl)penta-1,4-dien-3-yl]oxy-trimethylsilane?
[(1E,4E)-1,5-diphenyl-3-(trifluoromethyl)penta-1,4-dien-3-yl]oxy-trimethylsilane has a molecular weight of 376.49 g/mol, XLogP of 6.57, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1E,4E)-1,5-diphenyl-3-(trifluoromethyl)penta-1,4-dien-3-yl]oxy-trimethylsilane is sourced from PubChem (CID 10714568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).