1-(4-fluorophenyl)-1-phenyl-2-triethylsilyloxyethanol

C20H27FO2Si — CID 134998890

IUPAC1-(4-fluorophenyl)-1-phenyl-2-triethylsilyloxyethanol
SMILESCC[Si](CC)(CC)OCC(O)(c1ccccc1)c1ccc(F)cc1
InChIInChI=1S/C20H27FO2Si/c1-4-24(5-2,6-3)23-16-20(22,17-10-8-7-9-11-17)18-12-14-19(21)15-13-18/h7-15,22H,4-6,16H2,1-3H3
InChIKeyDOUPRZFEJUUJQI-UHFFFAOYSA-N
MW346.52 g/mol
LogP5.08
Rot. Bonds8

About 1-(4-fluorophenyl)-1-phenyl-2-triethylsilyloxyethanol

1-(4-fluorophenyl)-1-phenyl-2-triethylsilyloxyethanol (PubChem CID 134998890) has the molecular formula C20H27FO2Si and a molecular weight of 346.52 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-1-phenyl-2-triethylsilyloxyethanol.

Molecular Properties

Compound Name1-(4-fluorophenyl)-1-phenyl-2-triethylsilyloxyethanol
PubChem CID134998890
Molecular FormulaC20H27FO2Si
Molecular Weight346.52 g/mol
Exact Mass346.18
IUPAC Name1-(4-fluorophenyl)-1-phenyl-2-triethylsilyloxyethanol
SMILESCC[Si](CC)(CC)OCC(O)(c1ccccc1)c1ccc(F)cc1
InChIInChI=1S/C20H27FO2Si/c1-4-24(5-2,6-3)23-16-20(22,17-10-8-7-9-11-17)18-12-14-19(21)15-13-18/h7-15,22H,4-6,16H2,1-3H3
InChIKeyDOUPRZFEJUUJQI-UHFFFAOYSA-N
XLogP5.08
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500346.52
LogP ≤ 55.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

1,2-Propanediol, 1,1-diphenyl-
CID 2748265
1,1,1,4,4,4-Hexafluoro-2,3-diphenylbutane-2,3-diol
CID 320082
2,3-Diphenyl-2,3-butanediol
CID 97886
(2S)-1,1-diphenylpropane-1,2-diol
CID 736300
2-(Dimethylphenylsilyl)benzyl alcohol
CID 11989421
2-[4-[Diethyl(methyl)silyl]phenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol
CID 168271253
1,1,1,3,3,3-Hexafluoro-2-(4-triethylsilylphenyl)propan-2-ol
CID 168272454
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(prop-2-enyl)silyl]phenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol
CID 168282113
2-[4-[Tert-butyl(dimethyl)silyl]phenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol
CID 168282164
2-[4-[Dimethyl(phenyl)silyl]phenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol
CID 168285849

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-1-phenyl-2-triethylsilyloxyethanol?
The IUPAC name of 1-(4-fluorophenyl)-1-phenyl-2-triethylsilyloxyethanol (CID 134998890) is 1-(4-fluorophenyl)-1-phenyl-2-triethylsilyloxyethanol.
What is the SMILES notation for 1-(4-fluorophenyl)-1-phenyl-2-triethylsilyloxyethanol?
The canonical SMILES for 1-(4-fluorophenyl)-1-phenyl-2-triethylsilyloxyethanol is CC[Si](CC)(CC)OCC(O)(c1ccccc1)c1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-1-phenyl-2-triethylsilyloxyethanol?
The InChIKey is DOUPRZFEJUUJQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27FO2Si/c1-4-24(5-2,6-3)23-16-20(22,17-10-8-7-9-11-17)18-12-14-19(21)15-13-18/h7-15,22H,4-6,16H2,1-3H3.
What are the key properties of 1-(4-fluorophenyl)-1-phenyl-2-triethylsilyloxyethanol?
1-(4-fluorophenyl)-1-phenyl-2-triethylsilyloxyethanol has a molecular weight of 346.52 g/mol, XLogP of 5.08, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-1-phenyl-2-triethylsilyloxyethanol is sourced from PubChem (CID 134998890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).