1-[(E)-1,2-difluoro-2-(4-methylphenyl)ethenyl]-4-(4-ethylcyclohexyl)benzene

C23H26F2 — CID 139790691

IUPAC1-[(E)-1,2-difluoro-2-(4-methylphenyl)ethenyl]-4-(4-ethylcyclohexyl)benzene
SMILESCCC1CCC(c2ccc(/C(F)=C(\F)c3ccc(C)cc3)cc2)CC1
InChIInChI=1S/C23H26F2/c1-3-17-6-10-18(11-7-17)19-12-14-21(15-13-19)23(25)22(24)20-8-4-16(2)5-9-20/h4-5,8-9,12-15,17-18H,3,6-7,10-11H2,1-2H3/b23-22+
InChIKeyIUSYOPFMMWGRGT-GHVJWSGMSA-N
MW340.46 g/mol
LogP7.44
Rot. Bonds4

About 1-[(E)-1,2-difluoro-2-(4-methylphenyl)ethenyl]-4-(4-ethylcyclohexyl)benzene

1-[(E)-1,2-difluoro-2-(4-methylphenyl)ethenyl]-4-(4-ethylcyclohexyl)benzene (PubChem CID 139790691) has the molecular formula C23H26F2 and a molecular weight of 340.46 g/mol. Its IUPAC name is 1-[(E)-1,2-difluoro-2-(4-methylphenyl)ethenyl]-4-(4-ethylcyclohexyl)benzene.

Molecular Properties

Compound Name1-[(E)-1,2-difluoro-2-(4-methylphenyl)ethenyl]-4-(4-ethylcyclohexyl)benzene
PubChem CID139790691
Molecular FormulaC23H26F2
Molecular Weight340.46 g/mol
Exact Mass340.20
IUPAC Name1-[(E)-1,2-difluoro-2-(4-methylphenyl)ethenyl]-4-(4-ethylcyclohexyl)benzene
SMILESCCC1CCC(c2ccc(/C(F)=C(\F)c3ccc(C)cc3)cc2)CC1
InChIInChI=1S/C23H26F2/c1-3-17-6-10-18(11-7-17)19-12-14-21(15-13-19)23(25)22(24)20-8-4-16(2)5-9-20/h4-5,8-9,12-15,17-18H,3,6-7,10-11H2,1-2H3/b23-22+
InChIKeyIUSYOPFMMWGRGT-GHVJWSGMSA-N
XLogP7.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.46
LogP ≤ 57.44
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-[1,2-difluoro-2-(4-fluorophenyl)ethenyl]-4-(4-ethylcyclohexyl)benzene
CID 175685460
tris(1-(4-butylcyclohexyl)-4-methylbenzene);tetrakis(1-(4-ethylcyclohexyl)-4-methylbenzene);tetrakis(1-methyl-4-(4-propylcyclohexyl)benzene)
CID 158284409
1-cyclopropyl-4-methylbenzene;methanol
CID 143290478
2-bromo-1-[4-(4-ethylcyclohexyl)phenyl]ethanone
CID 102133235
1-(4-ethylcyclohexyl)-4-(4-propylcyclohexyl)benzene
CID 20538372
1-bromo-4-[4-(4-ethylcyclohexyl)phenyl]benzene
CID 170842748
1-[(Z)-1,2-difluoro-2-[4-[(E)-pent-1-enyl]phenyl]ethenyl]-4-(4-propylcyclohexyl)benzene
CID 67699851
1-cyclopropyl-4-methylbenzene;ethane;methane
CID 164862835
1-methyl-4-[4-[4-(4-methylphenyl)cyclohexyl]phenyl]benzene
CID 59265320
1-[(E)-1,2-difluoro-2-[4-(4-methylcyclohexyl)phenyl]ethenyl]-4-ethoxybenzene
CID 139790644
[4-[4-(4-methylphenyl)phenyl]cyclohexyl]methylsilane
CID 123942923
CID 20632431
CID 20632431

Frequently Asked Questions

What is the IUPAC name of 1-[(E)-1,2-difluoro-2-(4-methylphenyl)ethenyl]-4-(4-ethylcyclohexyl)benzene?
The IUPAC name of 1-[(E)-1,2-difluoro-2-(4-methylphenyl)ethenyl]-4-(4-ethylcyclohexyl)benzene (CID 139790691) is 1-[(E)-1,2-difluoro-2-(4-methylphenyl)ethenyl]-4-(4-ethylcyclohexyl)benzene.
What is the SMILES notation for 1-[(E)-1,2-difluoro-2-(4-methylphenyl)ethenyl]-4-(4-ethylcyclohexyl)benzene?
The canonical SMILES for 1-[(E)-1,2-difluoro-2-(4-methylphenyl)ethenyl]-4-(4-ethylcyclohexyl)benzene is CCC1CCC(c2ccc(/C(F)=C(\F)c3ccc(C)cc3)cc2)CC1.
What is the InChIKey of 1-[(E)-1,2-difluoro-2-(4-methylphenyl)ethenyl]-4-(4-ethylcyclohexyl)benzene?
The InChIKey is IUSYOPFMMWGRGT-GHVJWSGMSA-N. The full InChI is InChI=1S/C23H26F2/c1-3-17-6-10-18(11-7-17)19-12-14-21(15-13-19)23(25)22(24)20-8-4-16(2)5-9-20/h4-5,8-9,12-15,17-18H,3,6-7,10-11H2,1-2H3/b23-22+.
What are the key properties of 1-[(E)-1,2-difluoro-2-(4-methylphenyl)ethenyl]-4-(4-ethylcyclohexyl)benzene?
1-[(E)-1,2-difluoro-2-(4-methylphenyl)ethenyl]-4-(4-ethylcyclohexyl)benzene has a molecular weight of 340.46 g/mol, XLogP of 7.44, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-1,2-difluoro-2-(4-methylphenyl)ethenyl]-4-(4-ethylcyclohexyl)benzene is sourced from PubChem (CID 139790691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).