(4Z)-4-benzylidene-2,5-diphenyl-2-(trifluoromethyl)-1,3-dioxolane

C23H17F3O2 — CID 139242322

IUPAC(4Z)-4-benzylidene-2,5-diphenyl-2-(trifluoromethyl)-1,3-dioxolane
SMILESFC(F)(F)C1(c2ccccc2)O/C(=C\c2ccccc2)C(c2ccccc2)O1
InChIInChI=1S/C23H17F3O2/c24-23(25,26)22(19-14-8-3-9-15-19)27-20(16-17-10-4-1-5-11-17)21(28-22)18-12-6-2-7-13-18/h1-16,21H/b20-16-
InChIKeyGGAHPUZIVAOYJZ-SILNSSARSA-N
MW382.38 g/mol
LogP6.23
Rot. Bonds3

About (4Z)-4-benzylidene-2,5-diphenyl-2-(trifluoromethyl)-1,3-dioxolane

(4Z)-4-benzylidene-2,5-diphenyl-2-(trifluoromethyl)-1,3-dioxolane (PubChem CID 139242322) has the molecular formula C23H17F3O2 and a molecular weight of 382.38 g/mol. Its IUPAC name is (4Z)-4-benzylidene-2,5-diphenyl-2-(trifluoromethyl)-1,3-dioxolane.

Molecular Properties

Compound Name(4Z)-4-benzylidene-2,5-diphenyl-2-(trifluoromethyl)-1,3-dioxolane
PubChem CID139242322
Molecular FormulaC23H17F3O2
Molecular Weight382.38 g/mol
Exact Mass382.12
IUPAC Name(4Z)-4-benzylidene-2,5-diphenyl-2-(trifluoromethyl)-1,3-dioxolane
SMILESFC(F)(F)C1(c2ccccc2)O/C(=C\c2ccccc2)C(c2ccccc2)O1
InChIInChI=1S/C23H17F3O2/c24-23(25,26)22(19-14-8-3-9-15-19)27-20(16-17-10-4-1-5-11-17)21(28-22)18-12-6-2-7-13-18/h1-16,21H/b20-16-
InChIKeyGGAHPUZIVAOYJZ-SILNSSARSA-N
XLogP6.23
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500382.38
LogP ≤ 56.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,1-Dibenzyloxy-2-phenylethane
CID 95980
2,5-Dimethoxy-2,5-diphenyl-1,4-dioxane
CID 5059104
1,4-Dioxaspiro[4.5]decane, 2-phenyl-
CID 97830
2-Methyl-2-[4-[[4-(2-methyl-1,3-dioxolan-2-yl)phenyl]ditellanyl]phenyl]-1,3-dioxolane
CID 13068972
2-Methyl-2-[3-[[3-(2-methyl-1,3-dioxolan-2-yl)phenyl]ditellanyl]phenyl]-1,3-dioxolane
CID 155538832
2-Methyl-2-[2-[[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]ditellanyl]phenyl]-1,3-dioxolane
CID 23162638
2,2-Diphenyldioxolane
CID 283230
Tri-O-benzyl-D-galactal
CID 2734741
Dicyclohexyl(2-(2-methyl-1,3-dioxolan-2-yl)phenyl)phosphine
CID 11078910
Benzene, 1,1'-[(phenylmethylene)bis(oxymethylene)]bis-
CID 12272857
2,2-Bis(4-methylphenyl)-1,3-dioxolane
CID 53996432
Tri-O-benzyl-D-glucal
CID 11742644

Frequently Asked Questions

What is the IUPAC name of (4Z)-4-benzylidene-2,5-diphenyl-2-(trifluoromethyl)-1,3-dioxolane?
The IUPAC name of (4Z)-4-benzylidene-2,5-diphenyl-2-(trifluoromethyl)-1,3-dioxolane (CID 139242322) is (4Z)-4-benzylidene-2,5-diphenyl-2-(trifluoromethyl)-1,3-dioxolane.
What is the SMILES notation for (4Z)-4-benzylidene-2,5-diphenyl-2-(trifluoromethyl)-1,3-dioxolane?
The canonical SMILES for (4Z)-4-benzylidene-2,5-diphenyl-2-(trifluoromethyl)-1,3-dioxolane is FC(F)(F)C1(c2ccccc2)O/C(=C\c2ccccc2)C(c2ccccc2)O1.
What is the InChIKey of (4Z)-4-benzylidene-2,5-diphenyl-2-(trifluoromethyl)-1,3-dioxolane?
The InChIKey is GGAHPUZIVAOYJZ-SILNSSARSA-N. The full InChI is InChI=1S/C23H17F3O2/c24-23(25,26)22(19-14-8-3-9-15-19)27-20(16-17-10-4-1-5-11-17)21(28-22)18-12-6-2-7-13-18/h1-16,21H/b20-16-.
What are the key properties of (4Z)-4-benzylidene-2,5-diphenyl-2-(trifluoromethyl)-1,3-dioxolane?
(4Z)-4-benzylidene-2,5-diphenyl-2-(trifluoromethyl)-1,3-dioxolane has a molecular weight of 382.38 g/mol, XLogP of 6.23, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-4-benzylidene-2,5-diphenyl-2-(trifluoromethyl)-1,3-dioxolane is sourced from PubChem (CID 139242322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).