Chemical Properties of «alpha»-D-Glucopyranoside, 1,3,4,6-tetra-O-methyl-«beta»-D-fructofuranosyl 2,3,4-tri-O-methyl-6-O-(2,3,4,6-tetra-O-methyl-«alpha»-D-galactopyranosyl)- (CAS 34141-00-9)

«alpha»-D-Glucopyranoside, 1,3,4,6-tetra-O-methyl-«beta»-D-fructofuranosyl 2,3,4-tri-O-methyl-6-O-(2,3,4,6-tetra-O-methyl-«alpha»-D-galactopyranosyl)-

InChI
InChI=1S/C29H54O16/c1-30-12-16-19(33-4)22(36-7)24(38-9)27(42-16)41-14-17-20(34-5)23(37-8)25(39-10)28(43-17)45-29(15-32-3)26(40-11)21(35-6)18(44-29)13-31-2/h16-28H,12-15H2,1-11H3/t16?,17-,18?,19?,20-,21?,22?,23+,24?,25-,26?,27?,28-,29?/m1/s1
InChI Key
CODTYWQHUHJXKQ-UHFQAHCESA-N
Formula
C29H54O16
SMILES
COCC1OC(OCC2OC(OC3(COC)OC(COC)C(OC)C3OC)C(OC)C(OC)C2OC)C(OC)C(OC)C1OC
Molecular Weight1
658.73
CAS
34141-00-9
Other Names
  • Glucopyranoside, 1,3,4,6-tetra-O-methyl-«beta»-D-fructofuranosyl 2,3,4-tri-O-methyl-6-O-(2,3,4,6-tetra-O-methyl-«alpha»-D-galactopyranosyl)-, «alpha»-D-
  • Raffinose, permethyl
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfusH° 93.34 kJ/mol Joback Calculated Property
logPoct/wat -0.376 Crippen Calculated Property
McVol 480.810 ml/mol McGowan Calculated Property

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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [784.54; 1848.55] 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 A1.83634e+02
Coefficient B2.30472e+00
Coefficient C-2.81700e-04
Coefficient D-3.58100e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 784.54 J/mol×K 273.00 Calculated Property
Cp,gas 947.88 J/mol×K 353.78 Calculated Property
Cp,gas 1102.58 J/mol×K 434.56 Calculated Property
Cp,gas 1247.51 J/mol×K 515.33 Calculated Property
Cp,gas 1381.55 J/mol×K 596.11 Calculated Property
Cp,gas 1503.54 J/mol×K 676.89 Calculated Property
Cp,gas 1612.38 J/mol×K 757.67 Calculated Property
Cp,gas 1706.91 J/mol×K 838.44 Calculated Property
Cp,gas 1786.01 J/mol×K 919.22 Calculated Property
Cp,gas 1848.55 J/mol×K 1000.00 Calculated Property

Similar Compounds

Stachyose, permethyl. «alpha»-D-Glucopyranoside, 1,3,4,6-tetra-O-methyl-«beta»-D-fructofuranosyl 2,3,4,6-tetra-O-methyl-. Sucrose Octaacetate. Laminaritriose, permethyl. Laminaritetraose, permethyl. «alpha»-D-Glucopyranoside, 2,3,4,6-tetra-O-methyl-«alpha»-D-glucopyranosyl 2,3,4,6-tetra-O-methyl-. Gentiobiose, permethyl. Melibiose, permethyl. Isomaltotriose, permethyl. Isomaltose, permethyl. Maltotriose, permethyl. Maltotetraose, permethyl. Sophorose, permethyl. «alpha»-D-Mannopyranoside, permethylated. «alpha»-D-Galactopyranoside, permethylated.

Find more compounds similar to «alpha»-D-Glucopyranoside, 1,3,4,6-tetra-O-methyl-«beta»-D-fructofuranosyl 2,3,4-tri-O-methyl-6-O-(2,3,4,6-tetra-O-methyl-«alpha»-D-galactopyranosyl)-.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
These property values are available through the Cheméo API. A free account gives you an access key.