Chemical Properties of (S)-LInalool, B-D-Glu, TFA

(S)-LInalool, B-D-Glu, TFA

InChI
InChI=1S/C24H24F12O10/c1-5-20(4,8-6-7-10(2)3)46-15-14(45-19(40)24(34,35)36)13(44-18(39)23(31,32)33)12(43-17(38)22(28,29)30)11(42-15)9-41-16(37)21(25,26)27/h5,7,11-15H,1,6,8-9H2,2-4H3
InChI Key
PXNCKBQISHIDRF-UHFFFAOYSA-N
Formula
C24H24F12O10
SMILES
C=CC(C)(CCC=C(C)C)OC1OC(COC(=O)C(F)(F)F)C(OC(=O)C(F)(F)F)C(OC(=O)C(F)(F)F)C1OC(=O)C(F)(F)F
Molecular Weight1
700.42
Other Names
  • ( S)-linalyl «beta»-D-glucopyranoside, TFA
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Physical Properties

Property Value Unit Source
ΔfusH° 78.18 kJ/mol Joback Calculated Property
logPoct/wat 4.947 Crippen Calculated Property
McVol 392.300 ml/mol McGowan Calculated Property
Inp [1799.00; 1799.00]   Show Hide
Inp 1799.00 NIST
Inp 1799.00 NIST
Tboil 619.89 K Relay (1.0) Calculated Property

Cheméo can also estimate 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 [1374.74; 1409.95] J/mol×K [1007.65; 1252.89] Show Hide
Cp,gas 1374.74 J/mol×K 1007.65 Joback Calculated Property
Cp,gas 1385.37 J/mol×K 1048.52 Joback Calculated Property
Cp,gas 1393.89 J/mol×K 1089.40 Joback Calculated Property
Cp,gas 1400.45 J/mol×K 1130.27 Joback Calculated Property
Cp,gas 1405.22 J/mol×K 1171.14 Joback Calculated Property
Cp,gas 1408.33 J/mol×K 1212.01 Joback Calculated Property
Cp,gas 1409.95 J/mol×K 1252.89 Joback Calculated Property

Similar Compounds

Linalool, Gly, TFA. (S)-Linalol «beta»-D-glucopyranoside, TFA. ( S)-linalyl 6- O-(«alpha»-L-rhamonopyranosyl)-«beta»-D-glucopyranoside, TFA. (S)-Linalol rutinoside, TFA. furanlinalyloxide 6- O-(«beta»-D-apiofuranosyl)-«beta»-D-glucopyranoside, TFA. furan linalyloxide «beta»-D-glucopyranoside ( Z/ E), TFA. (Z)-Linalol furanoxide «beta»-D-glucopyranoside, TFA. Linalool oxide (furanoid) «beta»-D-glucopyranoside, TFA. Linalool oxide (furanoid), trans, «beta»-D-glucopyranoside, TFA. furan linalyloxide «beta»-D-glucopyranoside ( E/ Z), TFA. Linalool oxide (pyranoid), trans, «beta»-D-glucopyranoside, TFA. Linalool oxide (pyranoid), cis, «beta»-D-glucopyranoside, TFA. 3-Oxo-.alpha.-ionol, Gly, TFA. 4-Oxo-«beta»-ionol, Gly, TFA. 3,6-Epoxy-7-megastigmen-5,9-diol «beta»-D-glucopyranoside, TFA.

Find more compounds similar to (S)-LInalool, B-D-Glu, TFA.

Sources

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