2-fluoro-1-[2-(4-fluorophenyl)ethenyl]-4-[(2R)-2-phenylpropyl]benzene

C23H20F2 — CID 58698775

IUPAC2-fluoro-1-[2-(4-fluorophenyl)ethenyl]-4-[(2R)-2-phenylpropyl]benzene
SMILESC[C@H](Cc1ccc(C=Cc2ccc(F)cc2)c(F)c1)c1ccccc1
InChIInChI=1S/C23H20F2/c1-17(20-5-3-2-4-6-20)15-19-8-12-21(23(25)16-19)11-7-18-9-13-22(24)14-10-18/h2-14,16-17H,15H2,1H3/t17-/m1/s1
InChIKeyVAUDBMPYMAJGRT-QGZVFWFLSA-N
MW334.41 g/mol
LogP6.48
Rot. Bonds5

About 2-fluoro-1-[2-(4-fluorophenyl)ethenyl]-4-[(2R)-2-phenylpropyl]benzene

2-fluoro-1-[2-(4-fluorophenyl)ethenyl]-4-[(2R)-2-phenylpropyl]benzene (PubChem CID 58698775) has the molecular formula C23H20F2 and a molecular weight of 334.41 g/mol. Its IUPAC name is 2-fluoro-1-[2-(4-fluorophenyl)ethenyl]-4-[(2R)-2-phenylpropyl]benzene.

Molecular Properties

Compound Name2-fluoro-1-[2-(4-fluorophenyl)ethenyl]-4-[(2R)-2-phenylpropyl]benzene
PubChem CID58698775
Molecular FormulaC23H20F2
Molecular Weight334.41 g/mol
Exact Mass334.15
IUPAC Name2-fluoro-1-[2-(4-fluorophenyl)ethenyl]-4-[(2R)-2-phenylpropyl]benzene
SMILESC[C@H](Cc1ccc(C=Cc2ccc(F)cc2)c(F)c1)c1ccccc1
InChIInChI=1S/C23H20F2/c1-17(20-5-3-2-4-6-20)15-19-8-12-21(23(25)16-19)11-7-18-9-13-22(24)14-10-18/h2-14,16-17H,15H2,1H3/t17-/m1/s1
InChIKeyVAUDBMPYMAJGRT-QGZVFWFLSA-N
XLogP6.48
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.41
LogP ≤ 56.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2,4-difluoro-1-[2-[4-[2-[4-[(2R)-2-phenylpropyl]phenyl]ethyl]phenyl]ethenyl]benzene
CID 58698840
2-fluoro-1-[2-[4-[(2S)-2-phenylpropyl]phenyl]ethenyl]-4-propylbenzene
CID 58698548
2-fluoro-1-[2-(4-pent-3-enylphenyl)ethenyl]-4-[(2R)-2-phenylpropyl]benzene
CID 91188184
2-fluoro-1-[(E)-2-[4-(2-phenylpropyl)phenyl]ethenyl]-4-[2-(4-propylphenyl)ethyl]benzene
CID 21052760
1,3-difluoro-2-[2-(4-fluorophenyl)ethenyl]-5-[(2R)-2-phenylpropyl]benzene
CID 58698930
2-fluoro-1-[2-[4-[2-[4-[(E)-pent-3-enyl]phenyl]ethyl]phenyl]ethenyl]-4-[(2R)-2-phenylpropyl]benzene
CID 58699470
2-fluoro-4-[(E)-pent-3-enyl]-1-[2-[4-[(2R)-2-phenylpropyl]phenyl]ethenyl]benzene
CID 58698594
1-fluoro-4-[4-[(E)-2-[4-(2-phenylpropyl)phenyl]ethenyl]phenyl]benzene
CID 21052442
2-fluoro-1-[2-[4-[4-[(2S)-2-phenylpropyl]phenyl]phenyl]ethenyl]-4-[2-(4-propylphenyl)ethyl]benzene
CID 58698355
2-fluoro-4-[2-(4-pent-3-enylphenyl)ethyl]-1-[2-[4-[(2R)-2-phenylpropyl]phenyl]ethenyl]benzene
CID 91375296
2-fluoro-4-[4-[(2R)-2-phenylpropyl]phenyl]-1-[2-[4-(4-propylphenyl)phenyl]ethenyl]benzene
CID 58698086
2,4-difluoro-1-[2-[3-fluoro-4-[(2R)-2-phenylpropyl]phenyl]ethenyl]benzene
CID 58698107

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-1-[2-(4-fluorophenyl)ethenyl]-4-[(2R)-2-phenylpropyl]benzene?
The IUPAC name of 2-fluoro-1-[2-(4-fluorophenyl)ethenyl]-4-[(2R)-2-phenylpropyl]benzene (CID 58698775) is 2-fluoro-1-[2-(4-fluorophenyl)ethenyl]-4-[(2R)-2-phenylpropyl]benzene.
What is the SMILES notation for 2-fluoro-1-[2-(4-fluorophenyl)ethenyl]-4-[(2R)-2-phenylpropyl]benzene?
The canonical SMILES for 2-fluoro-1-[2-(4-fluorophenyl)ethenyl]-4-[(2R)-2-phenylpropyl]benzene is C[C@H](Cc1ccc(C=Cc2ccc(F)cc2)c(F)c1)c1ccccc1.
What is the InChIKey of 2-fluoro-1-[2-(4-fluorophenyl)ethenyl]-4-[(2R)-2-phenylpropyl]benzene?
The InChIKey is VAUDBMPYMAJGRT-QGZVFWFLSA-N. The full InChI is InChI=1S/C23H20F2/c1-17(20-5-3-2-4-6-20)15-19-8-12-21(23(25)16-19)11-7-18-9-13-22(24)14-10-18/h2-14,16-17H,15H2,1H3/t17-/m1/s1.
What are the key properties of 2-fluoro-1-[2-(4-fluorophenyl)ethenyl]-4-[(2R)-2-phenylpropyl]benzene?
2-fluoro-1-[2-(4-fluorophenyl)ethenyl]-4-[(2R)-2-phenylpropyl]benzene has a molecular weight of 334.41 g/mol, XLogP of 6.48, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-1-[2-(4-fluorophenyl)ethenyl]-4-[(2R)-2-phenylpropyl]benzene is sourced from PubChem (CID 58698775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).