CAS 306-94-5|Perfluorodecalin|Perfluorodecahydronaphthalene|octadecafluoro-decahydronaphthalene|Octadecafluorodecahydronaphthalene|FDC|Perfluorodecahydronaphthalene (cis+trans)|全氟十氢萘（顺反异构体...

General Information

Structure

Molecular Formula

C₁₀F₁₈

Molecular Mass

462.0782576

Exact Mass

461.97125796

Charge

InChI

InChI=1S/C10F18/c11-1-2(12,5(17,18)9(25,26)7(21,22)3(1,13)14)6(19,20)10(27,28)8(23,24)4(1,15)16

InChIKey

UWEYRJFJVCLAGH-UHFFFAOYSA-N

Canonic Smiles

FC12C(F)(C(F)(F)C(C(C2(F)F)(F)F)(F)F)C(F)(F)C(C(C1(F)F)(F)F)(F)F

Isomeric Smiles

FC1(C(C2(F)C(C(F)(C(C(C2(F)C(C1(F)F)(F)F)(F)F)(F)F)F)(F)F)(F)F)F

Calculated Properties

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

5.802668

LogD (pH = 7.4)

5.802668

Log P

5.802668

Molar Refractivity

43.695

Polarizability

18.245485

Polar Surface Area

0.0

Rotatable Bonds

Lipinski's Rule of Five

false

Data Source

Names and Identifiers

Synonyms

PerfluorodecalinPerfluorodecahydronaphthaleneOctadecafluorodecahydronaphthalenePerfluorodecahydronaphthalene (cis+trans)全氟十氢萘（顺反异构体混合物）全氟萘烷Octadecafluorodecahydronaphthalene (cis+trans)Perfluorodecalin十八氟十氢萘（顺反异构体混合物）Perfluorodecalin全氟萘烷octadecafluorodecahydroNaphthaleneOctadecafluorodecahydronaphthalenePerfluoro(decahydronaphthalene), cis + trans全氟(十氢化萘),顺式+反式全氟十氢萘十八氟十氢萘OctadecafluorodecalinOctadecafluoro(decahydronaphthalene)

IUPAC name

octadecafluoro-decahydronaphthalene

IUPAC Traditional name

FDC perfluorodecalin

Names and Identifiers

Registration numbers

CAS Number

306-94-5

MDL Number

MFCD00010626

PubChem SID

1620850632489893024887159

PubChem CID

EC Number

Beilstein Number

Merck Index

Registration numbers

Properties

Related Proteins

No Data Available

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Molecular Spectra

No Data Available

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Molecule Details

Apollo Scientific

PC5960

Has ability to solubilise gases, e.g Oxygen can be used toaid oxidation of aldehydes, sulphides and alkenes.. Mixture of E/Z isomers

MP Biomedicals

05221317

MP Biomedicals Rare Chemical collection

Sigma Aldrich

P9900

Packaging
25 g in ampule

Molecule Details

References

PubChem Literature

From Data Sources

• The ability of perfluorinated solvents to solubilize gases, together with their unique phase properties, have been exploited in a system for oxidation of aldehydes to acids, sulfides to sulfoxides and sulfones, and alkenes to epoxides. The reactions are carried out in the presence of dissolved O₂, using a transition metal (Ru, Ni) catalyst with perfluorinated ligands, in a perfluoro(decahydronaphthalene)/toluene solvent mixture under monophasic conditions at 64^oC. On cooling, phase separation takes place, enabling the product to be isolated from the toluene phase, and the catalyst system to be recycled in the fluorous phase: Angew. Chem. Int. Ed., 36, 1454 (1997).

References

Bioactivity

PubChem BioAssay

Bioactivity