Chemical Properties of (-)-1,2:5,6-Di-O-cyclohexylidene-L-inositol, bis(trifluoroacetate)

(-)-1,2:5,6-Di-O-cyclohexylidene-L-inositol, bis(trifluoroacetate)

InChI
InChI=1S/C22H26F6O8/c23-21(24,25)17(29)31-11-12(32-18(30)22(26,27)28)14-16(36-20(34-14)9-5-2-6-10-20)15-13(11)33-19(35-15)7-3-1-4-8-19/h11-16H,1-10H2
InChI Key
NZBHEDMCLWMLFW-UHFFFAOYSA-N
Formula
C22H26F6O8
SMILES
O=C(OC1C(OC(=O)C(F)(F)F)C2OC3(CCCCC3)OC2C2OC3(CCCCC3)OC12)C(F)(F)F
Molecular Weight1
532.43
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Physical Properties

Property Value Unit Source
ΔfusH° 63.63 kJ/mol Joback Calculated Property
logPoct/wat 3.837 Crippen Calculated Property
McVol 315.520 ml/mol McGowan Calculated Property
Inp [2199.70; 2199.70]   Show Hide
Inp 2199.70 NIST
Inp 2199.70 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [468.06; 1239.77] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-2.78630e+02
Coefficient B3.48620e+00
Coefficient C-3.04540e-03
Coefficient D1.07760e-06
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 468.06 J/mol×K 273.00 Calculated Property
Cp,gas 621.27 J/mol×K 353.78 Calculated Property
Cp,gas 749.66 J/mol×K 434.56 Calculated Property
Cp,gas 856.64 J/mol×K 515.33 Calculated Property
Cp,gas 945.62 J/mol×K 596.11 Calculated Property
Cp,gas 1020.01 J/mol×K 676.89 Calculated Property
Cp,gas 1083.21 J/mol×K 757.67 Calculated Property
Cp,gas 1138.63 J/mol×K 838.44 Calculated Property
Cp,gas 1189.68 J/mol×K 919.22 Calculated Property
Cp,gas 1239.77 J/mol×K 1000.00 Calculated Property

Similar Compounds

(-)-1,2:5,6-Di-O-cyclohexylidene-L-inositol, diacetate. Hexanol .beta.-D-glucopyranoside, TFA. L-(-)-Fucopyranose, tetrakis(trifluoroacetate) (isomer 2). L-(+)-Rhamnopyranose, tetrakis(trifluoroacetate) (isomer 1). L-(+)-Rhamnopyranose, tetrakis(trifluoroacetate) (isomer 2). L-(-)-Fucopyranose, tetrakis(trifluoroacetate) (isomer 1). D-Fructopyranose, pentakis(trifluoroacetate). L-Sorbopyranose, pentakis(trifluoroacetate) (isomer 1). D-(-)-Tagatopyranose, pentakis(trifluoroacetate) (isomer 1). D-(-)-Tagatopyranose, pentakis(trifluoroacetate) (isomer 2). L-Sorbopyranose, pentakis(trifluoroacetate) (isomer 2). 1,6-Anhydro-2,3-O-isopropylidene-«beta»-D-mannopyranose, trifluoroacetate. D-(-)-Tagatofuranose, pentakis(trifluoroacetate) (isomer 2). D-(-)-Tagatofuranose, pentakis(trifluoroacetate) (isomer 1). D-(-)-Fructofuranose, pentakis(trifluoroacetate) (isomer 2).

Find more compounds similar to (-)-1,2:5,6-Di-O-cyclohexylidene-L-inositol, bis(trifluoroacetate).

Sources

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