chempirical

(R)-2,2′-Bis(trifluoromethanesulfonyloxy)-1,1′-binaphthyl

C22H12F6O6S2CAS 126613-06-7550.44 g/mol

Open in Covalent MOL file
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HalogenSulfone

Properties

Molecular formula
C22H12F6O6S2
Molar mass
550.44 g/mol
Exact mass
549.9979 Da
Melting point
64–74 °C
logP
6.12Crippen estimate
Polar surface area
86.7 Ų
H-bond donors / acceptors
0 / 6
Rotatable bonds
5

Identifiers

CAS number
126613-06-7
SMILES
O=S(=O)(Oc1ccc2ccccc2c1-c1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12)C(F)(F)F
InChIKey
OYJLCOSEYYZULE-UHFFFAOYSA-N
InChI
InChI=1S/C22H12F6O6S2/c23-21(24,25)35(29,30)33-17-11-9-13-5-1-3-7-15(13)19(17)20-16-8-4-2-6-14(16)10-12-18(20)34-36(31,32)22(26,27)28/h1-12H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

9 names
  • Methanesulfonic acid, 1,1,1-trifluoro-, 1,1′-(1R)-[1,1′-binaphthalene]-2,2′-diyl ester, stereoisomer
  • Methanesulfonic acid, trifluoro-, [1,1′-binaphthalene]-2,2′-diyl ester, (R)-
  • Methanesulfonic acid, trifluoro-, (1R)-[1,1′-binaphthalene]-2,2′-diyl ester
  • (R)-2,2′-Bis(trifluoromethanesulfonyloxy)-1,1′-binaphthalene
  • (R)-(-)-1,1′-Bi-2-naphthol bis(trifluoromethanesulfonate)
  • (R)-1,1′-Binaphthalene-2,2′-diyl bis(trifluoromethanesulfonate)
  • (R)-BINOL bis(triflate)
  • (R)-1,1′-Binaphthalene-2,2′-diyl ditriflate
  • (R)-BINOL ditriflate

Work with (R)-2,2′-Bis(trifluoromethanesulfonyloxy)-1,1′-binaphthyl

Predict the NMR spectrum1H and 13C shifts with multiplicities Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Same formula

(S)-Binol bis(triflate)128544-05-8 2,2′-Bis(trifluoromethanesulfonyloxy)-1,1′-binaphthyl128575-34-8

Elsewhere

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