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

C52H36F6 — CID 160707520

IUPAC1,2-bis[2-[2-[(Z)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]phenyl]ethenyl]benzene
SMILESFC(F)(F)c1ccc(/C(=C\c2ccccc2C=Cc2ccccc2C=Cc2ccccc2/C=C(/c2ccccc2)c2ccc(C(F)(F)F)cc2)c2ccccc2)cc1
InChIInChI=1S/C52H36F6/c53-51(54,55)47-31-27-43(28-32-47)49(41-17-3-1-4-18-41)35-45-21-11-9-15-39(45)25-23-37-13-7-8-14-38(37)24-26-40-16-10-12-22-46(40)36-50(42-19-5-2-6-20-42)44-29-33-48(34-30-44)52(56,57)58/h1-36H/b25-23?,26-24?,49-35-,50-36-
InChIKeyRRKNGUDSXCMWQE-YSNGDPFFSA-N
MW774.85 g/mol
LogP15.24
Rot. Bonds10

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

1,2-bis[2-[2-[(Z)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]phenyl]ethenyl]benzene (PubChem CID 160707520) has the molecular formula C52H36F6 and a molecular weight of 774.85 g/mol. Its IUPAC name is 1,2-bis[2-[2-[(Z)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]phenyl]ethenyl]benzene.

Molecular Properties

Compound Name1,2-bis[2-[2-[(Z)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]phenyl]ethenyl]benzene
PubChem CID160707520
Molecular FormulaC52H36F6
Molecular Weight774.85 g/mol
Exact Mass774.27
IUPAC Name1,2-bis[2-[2-[(Z)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]phenyl]ethenyl]benzene
SMILESFC(F)(F)c1ccc(/C(=C\c2ccccc2C=Cc2ccccc2C=Cc2ccccc2/C=C(/c2ccccc2)c2ccc(C(F)(F)F)cc2)c2ccccc2)cc1
InChIInChI=1S/C52H36F6/c53-51(54,55)47-31-27-43(28-32-47)49(41-17-3-1-4-18-41)35-45-21-11-9-15-39(45)25-23-37-13-7-8-14-38(37)24-26-40-16-10-12-22-46(40)36-50(42-19-5-2-6-20-42)44-29-33-48(34-30-44)52(56,57)58/h1-36H/b25-23?,26-24?,49-35-,50-36-
InChIKeyRRKNGUDSXCMWQE-YSNGDPFFSA-N
XLogP15.24
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500774.85
LogP ≤ 515.24
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

1,2-bis[(Z)-2-[2-[(Z)-2-(4-benzylphenyl)-2-phenylethenyl]phenyl]ethenyl]benzene
CID 163853364
3-phenyl-3-[4-(trifluoromethyl)phenyl]prop-2-en-1-ol
CID 68849939
CID 101352816
CID 101352816
2-[2-[2-(2,2-diphenylethenyl)phenyl]ethenyl]-3-[(Z)-2-[2-(2,2-diphenylethenyl)phenyl]ethenyl]anthracene
CID 163869385
1,4-bis[2-[2-[2-(4-benzylphenyl)-2-phenylethenyl]phenyl]ethenyl]benzene
CID 59119989
1-(1-phenylethenyl)-4-(trifluoromethyl)benzene
CID 10634268
2-[1-phenyl-2-[2-[2-[2-[2-[2-(2-phenyl-2-thiophen-2-ylethenyl)phenyl]ethenyl]phenyl]ethenyl]phenyl]ethenyl]thiophene
CID 59120118
CID 161391832
CID 161391832
2,3-bis[2-[2-[2,2-bis(4-phenylphenyl)ethenyl]phenyl]ethenyl]anthracene
CID 59120066
1-(trifluoromethyl)-4-[(Z)-2-[4-[1-[4-(trifluoromethyl)phenyl]ethenyl]phenyl]-1-[4-[(Z)-2-[4-(trifluoromethyl)phenyl]-2-[4-[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]phenyl]ethenyl]phenyl]ethenyl]benzene
CID 177464868
2-[(E)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]oxolane
CID 132915994
2,3-bis[(Z)-2-[2-[2,2-bis(4-methylphenyl)ethenyl]phenyl]ethenyl]anthracene
CID 163905286

Frequently Asked Questions

What is the IUPAC name of 1,2-bis[2-[2-[(Z)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]phenyl]ethenyl]benzene?
The IUPAC name of 1,2-bis[2-[2-[(Z)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]phenyl]ethenyl]benzene (CID 160707520) is 1,2-bis[2-[2-[(Z)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]phenyl]ethenyl]benzene.
What is the SMILES notation for 1,2-bis[2-[2-[(Z)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]phenyl]ethenyl]benzene?
The canonical SMILES for 1,2-bis[2-[2-[(Z)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]phenyl]ethenyl]benzene is FC(F)(F)c1ccc(/C(=C\c2ccccc2C=Cc2ccccc2C=Cc2ccccc2/C=C(/c2ccccc2)c2ccc(C(F)(F)F)cc2)c2ccccc2)cc1.
What is the InChIKey of 1,2-bis[2-[2-[(Z)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]phenyl]ethenyl]benzene?
The InChIKey is RRKNGUDSXCMWQE-YSNGDPFFSA-N. The full InChI is InChI=1S/C52H36F6/c53-51(54,55)47-31-27-43(28-32-47)49(41-17-3-1-4-18-41)35-45-21-11-9-15-39(45)25-23-37-13-7-8-14-38(37)24-26-40-16-10-12-22-46(40)36-50(42-19-5-2-6-20-42)44-29-33-48(34-30-44)52(56,57)58/h1-36H/b25-23?,26-24?,49-35-,50-36-.
What are the key properties of 1,2-bis[2-[2-[(Z)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]phenyl]ethenyl]benzene?
1,2-bis[2-[2-[(Z)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]phenyl]ethenyl]benzene has a molecular weight of 774.85 g/mol, XLogP of 15.24, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis[2-[2-[(Z)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]phenyl]ethenyl]benzene is sourced from PubChem (CID 160707520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).