1-fluoro-4-[1-(4-fluorophenyl)-1-phenylethyl]benzene

C20H16F2 — CID 58537150

IUPAC1-fluoro-4-[1-(4-fluorophenyl)-1-phenylethyl]benzene
SMILESCC(c1ccccc1)(c1ccc(F)cc1)c1ccc(F)cc1
InChIInChI=1S/C20H16F2/c1-20(15-5-3-2-4-6-15,16-7-11-18(21)12-8-16)17-9-13-19(22)14-10-17/h2-14H,1H3
InChIKeyXWSWAHSDTRLJGF-UHFFFAOYSA-N
MW294.34 g/mol
LogP5.32
Rot. Bonds3

About 1-fluoro-4-[1-(4-fluorophenyl)-1-phenylethyl]benzene

1-fluoro-4-[1-(4-fluorophenyl)-1-phenylethyl]benzene (PubChem CID 58537150) has the molecular formula C20H16F2 and a molecular weight of 294.34 g/mol. Its IUPAC name is 1-fluoro-4-[1-(4-fluorophenyl)-1-phenylethyl]benzene.

Molecular Properties

Compound Name1-fluoro-4-[1-(4-fluorophenyl)-1-phenylethyl]benzene
PubChem CID58537150
Molecular FormulaC20H16F2
Molecular Weight294.34 g/mol
Exact Mass294.12
IUPAC Name1-fluoro-4-[1-(4-fluorophenyl)-1-phenylethyl]benzene
SMILESCC(c1ccccc1)(c1ccc(F)cc1)c1ccc(F)cc1
InChIInChI=1S/C20H16F2/c1-20(15-5-3-2-4-6-15,16-7-11-18(21)12-8-16)17-9-13-19(22)14-10-17/h2-14H,1H3
InChIKeyXWSWAHSDTRLJGF-UHFFFAOYSA-N
XLogP5.32
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500294.34
LogP ≤ 55.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

1-fluoro-4-[(2R)-3-methyl-2-phenylbutan-2-yl]benzene
CID 143112976
1-(1,1-diphenylethyl)-4-phenylbenzene
CID 143113230
[4-[1,1-bis[4-[hydroxy(diphenyl)methyl]phenyl]ethyl]phenyl]-diphenylmethanol
CID 153299511
1-fluoro-4-[2-(4-fluorophenyl)propan-2-yl]benzene
CID 22572271
1-[2-[4-(benzenesulfonyl)phenyl]propan-2-yl]-4-fluorobenzene
CID 54306016
magnesium;bis(4-fluorophenyl)-phenylmethanolate;chloride
CID 130472570
1-tert-butyl-2-chlorobenzene;1-tert-butyl-4-fluorobenzene
CID 161456996
1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;1-methyl-4-[1-(4-methylphenyl)-1-phenylethyl]benzene
CID 158299637
1-(4-fluorophenyl)-2-phenylpropan-2-ol
CID 53329553
1-(1,1-diphenylethyl)-4-nitrosobenzene
CID 155112737
tert-butylbenzene;1-tert-butyl-4-chlorobenzene;1-tert-butyl-3,5-difluorobenzene;1-tert-butyl-4-fluorobenzene;ethane
CID 159434931
CID 87894107
CID 87894107

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-4-[1-(4-fluorophenyl)-1-phenylethyl]benzene?
The IUPAC name of 1-fluoro-4-[1-(4-fluorophenyl)-1-phenylethyl]benzene (CID 58537150) is 1-fluoro-4-[1-(4-fluorophenyl)-1-phenylethyl]benzene.
What is the SMILES notation for 1-fluoro-4-[1-(4-fluorophenyl)-1-phenylethyl]benzene?
The canonical SMILES for 1-fluoro-4-[1-(4-fluorophenyl)-1-phenylethyl]benzene is CC(c1ccccc1)(c1ccc(F)cc1)c1ccc(F)cc1.
What is the InChIKey of 1-fluoro-4-[1-(4-fluorophenyl)-1-phenylethyl]benzene?
The InChIKey is XWSWAHSDTRLJGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16F2/c1-20(15-5-3-2-4-6-15,16-7-11-18(21)12-8-16)17-9-13-19(22)14-10-17/h2-14H,1H3.
What are the key properties of 1-fluoro-4-[1-(4-fluorophenyl)-1-phenylethyl]benzene?
1-fluoro-4-[1-(4-fluorophenyl)-1-phenylethyl]benzene has a molecular weight of 294.34 g/mol, XLogP of 5.32, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-4-[1-(4-fluorophenyl)-1-phenylethyl]benzene is sourced from PubChem (CID 58537150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).