A compound for studying rotational dynamics
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Product Type

Biochemicals

4,4'-Dimethoxyoctafluorobiphenyl

Item No. 18652

Product Insert (PDF)Safety Data Sheet (SDS) (PDF)
Technical Information
Formal Name
2,2’,3,3’,5,5’,6,6’-octafluoro-4,4’-dimethoxy-1,1’-biphenyl
CAS Number
2200-71-7
Synonyms
  • NSC 97033
Molecular Formula
C14H6F8O2
Formula Weight
358.2
Purity
≥95%
Formulation (Request formulation change)
A crystalline solid
Solubility(Learn about Variance in Solubility)
DMF: 30 mg/mLDMSO: 20 mg/mLEthanol: 30 mg/mLEthanol:PBS (pH 7.2)(1:2): 0.3 mg/mL
λmax
244 nm
SMILES
COC1=C(F)C(F)=C(C2=C(F)C(F)=C(OC)C(F)=C2F)C(F)=C1F
InChi Code
InChI=1S/C14H6F8O2/c1-23-13-9(19)5(15)3(6(16)10(13)20)4-7(17)11(21)14(24-2)12(22)8(4)18/h1-2H3
InChi Key
TVUPJKALGKCABC-UHFFFAOYSA-N
Shipping & Storage Information
Storage
-20°C
Shipping
Room temperature in continental US; may vary elsewhere
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    1 g

    $55

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    5 g

    $165

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    Product Description

    4,4'-Dimethoxyoctafluorobiphenyl is a compound that has been used to investigate the relationship between intramolecular rotational dynamics and molecular and crystal structure using NMR spin-lattice relaxation experiments.1

    WARNING This product is not for human or veterinary use.

    References & Product Citations
    Product Description References

    1. Fahey, D.P., Dougherty, W.G., Jr., Kassel, W.S., et al. Nonexponential solid state 1H and 19F spin-lattice relaxation, single-crystal X-ray diffraction, and isolated-molecule and cluster electronic structure calculations in an organic solid: Coupled methyl group rotation and methoxy group libration in 4,4'-dimethoxyoctafluorobiphenyl. J. Phys. Chem. A 116(48), 11946-11956 (2012).