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

C20H25ClOSi — CID 139262132

IUPAC[(Z,3R)-3-(4-chlorophenyl)-1-phenylpent-1-enoxy]-trimethylsilane
SMILESCC[C@H](/C=C(\O[Si](C)(C)C)c1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C20H25ClOSi/c1-5-16(17-11-13-19(21)14-12-17)15-20(22-23(2,3)4)18-9-7-6-8-10-18/h6-16H,5H2,1-4H3/b20-15-/t16-/m1/s1
InChIKeyAULGWESAXPCESL-RUAUKMDKSA-N
MW344.96 g/mol
LogP6.73
Rot. Bonds6

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

[(Z,3R)-3-(4-chlorophenyl)-1-phenylpent-1-enoxy]-trimethylsilane (PubChem CID 139262132) has the molecular formula C20H25ClOSi and a molecular weight of 344.96 g/mol. Its IUPAC name is [(Z,3R)-3-(4-chlorophenyl)-1-phenylpent-1-enoxy]-trimethylsilane.

Molecular Properties

Compound Name[(Z,3R)-3-(4-chlorophenyl)-1-phenylpent-1-enoxy]-trimethylsilane
PubChem CID139262132
Molecular FormulaC20H25ClOSi
Molecular Weight344.96 g/mol
Exact Mass344.14
IUPAC Name[(Z,3R)-3-(4-chlorophenyl)-1-phenylpent-1-enoxy]-trimethylsilane
SMILESCC[C@H](/C=C(\O[Si](C)(C)C)c1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C20H25ClOSi/c1-5-16(17-11-13-19(21)14-12-17)15-20(22-23(2,3)4)18-9-7-6-8-10-18/h6-16H,5H2,1-4H3/b20-15-/t16-/m1/s1
InChIKeyAULGWESAXPCESL-RUAUKMDKSA-N
XLogP6.73
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.96
LogP ≤ 56.73
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

1-(4-Chlorophenyl)-1-phenylethanol
CID 14189996
2-(4-Chlorophenyl)-5,5-dimethyl-2-phenylfuran
CID 12283018
alpha-(Difluoromethylene)-4-chlorobenzyloxytrimethylsilane
CID 11747440
1-(4-Chlorophenyl)-1-phenylethanol, (S)-
CID 11974907
1-(4-Chlorophenyl)-2-phenylpropan-2-ol
CID 15438576
1-(4-Chlorophenyl)-1-phenylethanol, (R)-
CID 86312976
Triethyl(4-chlorobenzyloxy)silane
CID 580827
1-Chloro-4-((((1,1-dimethylethyl)dimethylsilyl)oxy)methyl)benzene
CID 11299849
Tert-butyl-[1-(4-chlorophenyl)but-3-enoxy]-dimethylsilane
CID 89510156
4,4-Dimethyl-1,3-diphenyl-1-(trimethylsilyloxy)-1-pentene
CID 624539
[(1S,2R)-1,2-bis(4-chlorophenyl)-3,3,4,4-tetrafluoro-2-trimethylsilyloxycyclobutyl]oxy-trimethylsilane
CID 15472630
[(Z,3R)-1-(4-fluorophenyl)-3-phenylpent-1-enoxy]-trimethylsilane
CID 102098356

Frequently Asked Questions

What is the IUPAC name of [(Z,3R)-3-(4-chlorophenyl)-1-phenylpent-1-enoxy]-trimethylsilane?
The IUPAC name of [(Z,3R)-3-(4-chlorophenyl)-1-phenylpent-1-enoxy]-trimethylsilane (CID 139262132) is [(Z,3R)-3-(4-chlorophenyl)-1-phenylpent-1-enoxy]-trimethylsilane.
What is the SMILES notation for [(Z,3R)-3-(4-chlorophenyl)-1-phenylpent-1-enoxy]-trimethylsilane?
The canonical SMILES for [(Z,3R)-3-(4-chlorophenyl)-1-phenylpent-1-enoxy]-trimethylsilane is CC[C@H](/C=C(\O[Si](C)(C)C)c1ccccc1)c1ccc(Cl)cc1.
What is the InChIKey of [(Z,3R)-3-(4-chlorophenyl)-1-phenylpent-1-enoxy]-trimethylsilane?
The InChIKey is AULGWESAXPCESL-RUAUKMDKSA-N. The full InChI is InChI=1S/C20H25ClOSi/c1-5-16(17-11-13-19(21)14-12-17)15-20(22-23(2,3)4)18-9-7-6-8-10-18/h6-16H,5H2,1-4H3/b20-15-/t16-/m1/s1.
What are the key properties of [(Z,3R)-3-(4-chlorophenyl)-1-phenylpent-1-enoxy]-trimethylsilane?
[(Z,3R)-3-(4-chlorophenyl)-1-phenylpent-1-enoxy]-trimethylsilane has a molecular weight of 344.96 g/mol, XLogP of 6.73, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z,3R)-3-(4-chlorophenyl)-1-phenylpent-1-enoxy]-trimethylsilane is sourced from PubChem (CID 139262132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).