[(Z,3R)-1-(4-fluorophenyl)-3-phenylpent-1-enoxy]-trimethylsilane

C20H25FOSi — CID 102098356

IUPAC[(Z,3R)-1-(4-fluorophenyl)-3-phenylpent-1-enoxy]-trimethylsilane
SMILESCC[C@H](/C=C(\O[Si](C)(C)C)c1ccc(F)cc1)c1ccccc1
InChIInChI=1S/C20H25FOSi/c1-5-16(17-9-7-6-8-10-17)15-20(22-23(2,3)4)18-11-13-19(21)14-12-18/h6-16H,5H2,1-4H3/b20-15-/t16-/m1/s1
InChIKeyYGOJHMZFDZLDGY-RUAUKMDKSA-N
MW328.50 g/mol
LogP6.21
Rot. Bonds6

About [(Z,3R)-1-(4-fluorophenyl)-3-phenylpent-1-enoxy]-trimethylsilane

[(Z,3R)-1-(4-fluorophenyl)-3-phenylpent-1-enoxy]-trimethylsilane (PubChem CID 102098356) has the molecular formula C20H25FOSi and a molecular weight of 328.50 g/mol. Its IUPAC name is [(Z,3R)-1-(4-fluorophenyl)-3-phenylpent-1-enoxy]-trimethylsilane.

Molecular Properties

Compound Name[(Z,3R)-1-(4-fluorophenyl)-3-phenylpent-1-enoxy]-trimethylsilane
PubChem CID102098356
Molecular FormulaC20H25FOSi
Molecular Weight328.50 g/mol
Exact Mass328.17
IUPAC Name[(Z,3R)-1-(4-fluorophenyl)-3-phenylpent-1-enoxy]-trimethylsilane
SMILESCC[C@H](/C=C(\O[Si](C)(C)C)c1ccc(F)cc1)c1ccccc1
InChIInChI=1S/C20H25FOSi/c1-5-16(17-9-7-6-8-10-17)15-20(22-23(2,3)4)18-11-13-19(21)14-12-18/h6-16H,5H2,1-4H3/b20-15-/t16-/m1/s1
InChIKeyYGOJHMZFDZLDGY-RUAUKMDKSA-N
XLogP6.21
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.50
LogP ≤ 56.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

Dicumyl peroxide
CID 6641
Benzene, [1-[(trimethylsilyl)oxy]ethenyl]-
CID 117406
(3,4-Dihydro-1-naphthyloxy)trimethylsilane
CID 4245325
2-[4-[Cyclohexyl(dimethyl)silyl]phenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol
CID 168278822
2-[4-[Benzyl(dimethyl)silyl]phenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol
CID 168281096
2-[4-[Dimethyl(phenyl)silyl]phenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol
CID 168285849
1,1,1,3,3,3-Hexafluoro-2-[4-(hydroxy-methyl-phenylsilyl)phenyl]propan-2-ol
CID 168289966
Silane, trimethyl(2,2,2-trifluoro-1,1-diphenylethoxy)-
CID 11255795
2,2-Difluoro-1-phenyl-1-trimethylsiloxyethene
CID 10889667
((1-(2-Fluorophenyl)vinyl)oxy)trimethylsilane
CID 10954822
Triethylsilyloxymethyl-4-fluorobenzene
CID 11107483
tert-Butyl(4-fluorobenzyloxy)dimethylsilane
CID 13861700

Frequently Asked Questions

What is the IUPAC name of [(Z,3R)-1-(4-fluorophenyl)-3-phenylpent-1-enoxy]-trimethylsilane?
The IUPAC name of [(Z,3R)-1-(4-fluorophenyl)-3-phenylpent-1-enoxy]-trimethylsilane (CID 102098356) is [(Z,3R)-1-(4-fluorophenyl)-3-phenylpent-1-enoxy]-trimethylsilane.
What is the SMILES notation for [(Z,3R)-1-(4-fluorophenyl)-3-phenylpent-1-enoxy]-trimethylsilane?
The canonical SMILES for [(Z,3R)-1-(4-fluorophenyl)-3-phenylpent-1-enoxy]-trimethylsilane is CC[C@H](/C=C(\O[Si](C)(C)C)c1ccc(F)cc1)c1ccccc1.
What is the InChIKey of [(Z,3R)-1-(4-fluorophenyl)-3-phenylpent-1-enoxy]-trimethylsilane?
The InChIKey is YGOJHMZFDZLDGY-RUAUKMDKSA-N. The full InChI is InChI=1S/C20H25FOSi/c1-5-16(17-9-7-6-8-10-17)15-20(22-23(2,3)4)18-11-13-19(21)14-12-18/h6-16H,5H2,1-4H3/b20-15-/t16-/m1/s1.
What are the key properties of [(Z,3R)-1-(4-fluorophenyl)-3-phenylpent-1-enoxy]-trimethylsilane?
[(Z,3R)-1-(4-fluorophenyl)-3-phenylpent-1-enoxy]-trimethylsilane has a molecular weight of 328.50 g/mol, XLogP of 6.21, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z,3R)-1-(4-fluorophenyl)-3-phenylpent-1-enoxy]-trimethylsilane is sourced from PubChem (CID 102098356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).