1,4-bis[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]benzene

C24H16F6 — CID 23624904

IUPAC1,4-bis[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]benzene
SMILESFC(F)(F)c1ccc(/C=C/c2ccc(/C=C/c3ccc(C(F)(F)F)cc3)cc2)cc1
InChIInChI=1S/C24H16F6/c25-23(26,27)21-13-9-19(10-14-21)7-5-17-1-2-18(4-3-17)6-8-20-11-15-22(16-12-20)24(28,29)30/h1-16H/b7-5+,8-6+
InChIKeyZBBFSQVDLHSTSL-KQQUZDAGSA-N
MW418.38 g/mol
LogP8.06
Rot. Bonds4

About 1,4-bis[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]benzene

1,4-bis[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]benzene (PubChem CID 23624904) has the molecular formula C24H16F6 and a molecular weight of 418.38 g/mol. Its IUPAC name is 1,4-bis[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]benzene.

Molecular Properties

Compound Name1,4-bis[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]benzene
PubChem CID23624904
Molecular FormulaC24H16F6
Molecular Weight418.38 g/mol
Exact Mass418.12
IUPAC Name1,4-bis[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]benzene
SMILESFC(F)(F)c1ccc(/C=C/c2ccc(/C=C/c3ccc(C(F)(F)F)cc3)cc2)cc1
InChIInChI=1S/C24H16F6/c25-23(26,27)21-13-9-19(10-14-21)7-5-17-1-2-18(4-3-17)6-8-20-11-15-22(16-12-20)24(28,29)30/h1-16H/b7-5+,8-6+
InChIKeyZBBFSQVDLHSTSL-KQQUZDAGSA-N
XLogP8.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500418.38
LogP ≤ 58.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,4-bis[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]benzene?
The IUPAC name of 1,4-bis[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]benzene (CID 23624904) is 1,4-bis[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]benzene.
What is the SMILES notation for 1,4-bis[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]benzene?
The canonical SMILES for 1,4-bis[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]benzene is FC(F)(F)c1ccc(/C=C/c2ccc(/C=C/c3ccc(C(F)(F)F)cc3)cc2)cc1.
What is the InChIKey of 1,4-bis[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]benzene?
The InChIKey is ZBBFSQVDLHSTSL-KQQUZDAGSA-N. The full InChI is InChI=1S/C24H16F6/c25-23(26,27)21-13-9-19(10-14-21)7-5-17-1-2-18(4-3-17)6-8-20-11-15-22(16-12-20)24(28,29)30/h1-16H/b7-5+,8-6+.
What are the key properties of 1,4-bis[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]benzene?
1,4-bis[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]benzene has a molecular weight of 418.38 g/mol, XLogP of 8.06, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-bis[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]benzene is sourced from PubChem (CID 23624904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).