Chemical Properties of furanlinalyloxide 6- O-(«beta»-D-apiofuranosyl)-«beta»-D-glucopyranoside, TFA

furanlinalyloxide 6- O-(«beta»-D-apiofuranosyl)-«beta»-D-glucopyranoside, TFA

InChI
InChI=1S/C33H30F18O17/c1-5-26(4)7-6-12(66-26)25(2,3)67-17-15(64-22(55)31(43,44)45)14(63-21(54)30(40,41)42)13(62-20(53)29(37,38)39)11(61-17)8-58-18-16(65-23(56)32(46,47)48)27(9-59-18,68-24(57)33(49,50)51)10-60-19(52)28(34,35)36/h5,11-18H,1,6-10H2,2-4H3/t11-,12?,13-,14+,15-,16+,17+,18-,26-,27?/m0/s1
InChI Key
FGBDKAZTUKSWQV-GGZOKKFMSA-N
Formula
C33H30F18O17
SMILES
C=CC1(C)CCC(C(C)(C)OC2OC(COC3OCC(COC(=O)C(F)(F)F)(OC(=O)C(F)(F)F)C3OC(=O)C(F)(F)F)C(OC(=O)C(F)(F)F)C(OC(=O)C(F)(F)F)C2OC(=O)C(F)(F)F)O1
Molecular Weight1
1040.55
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Physical Properties

Property Value Unit Source
ΔfusH° 110.62 kJ/mol Joback Calculated Property
logPoct/wat 4.849 Crippen Calculated Property
McVol 544.800 ml/mol McGowan Calculated Property
Inp 2167.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [917.43; 1988.02] 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-8.13380e+01
Coefficient B4.53146e+00
Coefficient C-3.47400e-03
Coefficient D1.01190e-06
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 917.43 J/mol×K 273.00 Calculated Property
Cp,gas 1131.80 J/mol×K 353.78 Calculated Property
Cp,gas 1314.85 J/mol×K 434.56 Calculated Property
Cp,gas 1469.77 J/mol×K 515.33 Calculated Property
Cp,gas 1599.78 J/mol×K 596.11 Calculated Property
Cp,gas 1708.07 J/mol×K 676.89 Calculated Property
Cp,gas 1797.84 J/mol×K 757.67 Calculated Property
Cp,gas 1872.29 J/mol×K 838.44 Calculated Property
Cp,gas 1934.61 J/mol×K 919.22 Calculated Property
Cp,gas 1988.02 J/mol×K 1000.00 Calculated Property

Similar Compounds

furan linalyloxide «beta»-D-glucopyranoside ( E/ Z), TFA. Linalool oxide (furanoid), trans, «beta»-D-glucopyranoside, TFA. (Z)-Linalol furanoxide «beta»-D-glucopyranoside, TFA. Linalool oxide (furanoid) «beta»-D-glucopyranoside, TFA. furan linalyloxide «beta»-D-glucopyranoside ( Z/ E), TFA. Linalool oxide (pyranoid), trans, «beta»-D-glucopyranoside, TFA. Linalool oxide (pyranoid), cis, «beta»-D-glucopyranoside, TFA. ( S)-linalyl 6- O-(«alpha»-L-rhamonopyranosyl)-«beta»-D-glucopyranoside, TFA. (S)-Linalol rutinoside, TFA. Linalool, Gly, TFA. (S)-Linalol «beta»-D-glucopyranoside, TFA. (S)-LInalool, B-D-Glu, TFA. 3,6-Epoxy-7-megastigmen-5,9-diol «beta»-D-glucopyranoside, TFA. neryl 6- O-(.beta.-D-apiofuranosyl)-.beta.-D-glucopyranoside, TFA. 3-Oxo-.alpha.-ionol, Gly, TFA.

Find more compounds similar to furanlinalyloxide 6- O-(«beta»-D-apiofuranosyl)-«beta»-D-glucopyranoside, TFA.

Sources

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