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

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [2236.77; 3299.96] J/mol×K [1408.48; 2041.28] Show Hide
Cp,gas 2236.77 J/mol×K 1408.48 Joback Calculated Property
Cp,gas 2327.83 J/mol×K 1513.95 Joback Calculated Property
Cp,gas 2443.85 J/mol×K 1619.41 Joback Calculated Property
Cp,gas 2591.95 J/mol×K 1724.88 Joback Calculated Property
Cp,gas 2779.26 J/mol×K 1830.35 Joback Calculated Property
Cp,gas 3012.88 J/mol×K 1935.81 Joback Calculated Property
Cp,gas 3299.96 J/mol×K 2041.28 Joback Calculated Property

Similar Compounds

Linalool oxide (furanoid), trans, «beta»-D-glucopyranoside, TFA. (Z)-Linalol furanoxide «beta»-D-glucopyranoside, TFA. furan linalyloxide «beta»-D-glucopyranoside ( E/ Z), TFA. Linalool oxide (furanoid) «beta»-D-glucopyranoside, TFA. furan linalyloxide «beta»-D-glucopyranoside ( Z/ E), TFA. Linalool oxide (pyranoid), cis, «beta»-D-glucopyranoside, TFA. Linalool oxide (pyranoid), trans, «beta»-D-glucopyranoside, TFA. (S)-Linalol rutinoside, TFA. ( S)-linalyl 6- O-(«alpha»-L-rhamonopyranosyl)-«beta»-D-glucopyranoside, TFA. (S)-LInalool, B-D-Glu, TFA. Linalool, Gly, TFA. (S)-Linalol «beta»-D-glucopyranoside, 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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