Chemical Properties of 1,6-Anhydro-.beta.-D-glucose, tris(trifluoroacetate)

1,6-Anhydro-.beta.-D-glucose, tris(trifluoroacetate)

InChI
InChI=1S/C12H7F9O8/c13-10(14,15)7(22)27-3-2-1-25-6(26-2)5(29-9(24)12(19,20)21)4(3)28-8(23)11(16,17)18/h2-6H,1H2
InChI Key
HZWRZZOGPUMZBK-UHFFFAOYSA-N
Formula
C12H7F9O8
SMILES
O=C(OC1C2COC(O2)C(OC(=O)C(F)(F)F)C1OC(=O)C(F)(F)F)C(F)(F)F
Molecular Weight1
450.16
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Physical Properties

Property Value Unit Source
ΔfusH° 56.66 kJ/mol Joback Calculated Property
logPoct/wat 1.164 Crippen Calculated Property
McVol 208.210 ml/mol McGowan Calculated Property
Inp [1179.20; 1179.20]   Show Hide
Inp 1179.20 NIST
Inp 1179.20 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [363.31; 752.84] 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-8.66000e+00
Coefficient B1.66010e+00
Coefficient C-1.16180e-03
Coefficient D2.63200e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 363.31 J/mol×K 273.00 Calculated Property
Cp,gas 444.89 J/mol×K 353.78 Calculated Property
Cp,gas 514.95 J/mol×K 434.56 Calculated Property
Cp,gas 574.33 J/mol×K 515.33 Calculated Property
Cp,gas 623.85 J/mol×K 596.11 Calculated Property
Cp,gas 664.36 J/mol×K 676.89 Calculated Property
Cp,gas 696.68 J/mol×K 757.67 Calculated Property
Cp,gas 721.64 J/mol×K 838.44 Calculated Property
Cp,gas 740.09 J/mol×K 919.22 Calculated Property
Cp,gas 752.84 J/mol×K 1000.00 Calculated Property

Similar Compounds

1,6-Anhydro-2,3-O-isopropylidene-«beta»-D-mannopyranose, trifluoroacetate. «beta»-D-Glucopyranose, 1,6-anhydro-, triacetate. Hexanol «beta»-D-glucopyranoside, TFA. Hexanol .beta.-D-glucopyranoside, TFA. D-(+)-Talopyranose, pentakis(trifluoroacetate). D-(+)-Galactopyranose, pentakis(trifluoroacetate) (isomer 2). D-(+)-Galactopyranose, pentakis(trifluoroacetate) (isomer 1). D-(+)-Glucose, pentakis(trifluoroacetate) (isomer 1). D-Allopyranose, pentakis(trifluoroacetate) (isomer 2). D-Allopyranose, pentakis(trifluoroacetate) (isomer 1). D-(+)-Mannopyranose, pentakis(trifluoroacetate) (isomer 2). D-(+)-Glucose, pentakis(trifluoroacetate) (isomer 2). D-(+)-Mannopyranose, pentakis(trifluoroacetate) (isomer 1). Glucose, 3-ethyl, acetylated. Glucose, 3,6-diethyl, acetylated.

Find more compounds similar to 1,6-Anhydro-.beta.-D-glucose, tris(trifluoroacetate).

Sources

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