Chemical Properties of Sucrose Octaacetate (CAS 126-14-7)

Sucrose Octaacetate

InChI
InChI=1S/C28H38O19/c1-12(29)37-9-20-22(40-15(4)32)24(42-17(6)34)25(43-18(7)35)27(45-20)47-28(11-39-14(3)31)26(44-19(8)36)23(41-16(5)33)21(46-28)10-38-13(2)30/h20-27H,9-11H2,1-8H3
InChI Key
ZIJKGAXBCRWEOL-UHFFFAOYSA-N
Formula
C28H38O19
SMILES
CC(=O)OCC1OC(OC2(COC(C)=O)OC(COC(C)=O)C(OC(C)=O)C2OC(C)=O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O
Molecular Weight1
678.59
CAS
126-14-7
Other Names
  • D-(+)-Sucrose octaacetate
  • Octaacetyl sucrose
  • Saccharose octaacetate
  • Soa
  • Sucrose, octaacetate
  • «alpha»-D-Glucopyranoside, 1,3,4,6-tetra-O-acetyl-«beta»-D-fructofuranosyl, tetraacetate
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Physical Properties

Property Value Unit Source
ΔfusH° 107.34 kJ/mol Joback Calculated Property
logPoct/wat -0.829 Crippen Calculated Property
McVol 460.790 ml/mol McGowan Calculated Property
Tfus [359.65; 360.00] K Show Hide
Tfus 359.65 K Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value
Tfus 360.00 ± 4.00 K NIST

Cheméo can also estimate Normal Boiling Point Temperature, 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 [720.87; 1608.60] 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 A1.06343e+02
Coefficient B2.51656e+00
Coefficient C-9.57000e-04
Coefficient D-5.73000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 720.87 J/mol×K 273.00 Calculated Property
Cp,gas 874.33 J/mol×K 353.78 Calculated Property
Cp,gas 1014.51 J/mol×K 434.56 Calculated Property
Cp,gas 1141.22 J/mol×K 515.33 Calculated Property
Cp,gas 1254.29 J/mol×K 596.11 Calculated Property
Cp,gas 1353.53 J/mol×K 676.89 Calculated Property
Cp,gas 1438.76 J/mol×K 757.67 Calculated Property
Cp,gas 1509.80 J/mol×K 838.44 Calculated Property
Cp,gas 1566.48 J/mol×K 919.22 Calculated Property
Cp,gas 1608.60 J/mol×K 1000.00 Calculated Property

Similar Compounds

«alpha»-D-Glucopyranoside, 1,3,4,6-tetra-O-methyl-«beta»-D-fructofuranosyl 2,3,4,6-tetra-O-methyl-. «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)-. Stachyose, permethyl. «beta»-D-Glucopyranose, 1,6-anhydro-, triacetate. 1,6-Anhydro-2,3-O-isopropylidene-«beta»-D-mannopyranose, trifluoroacetate. 4-Methyl-1,2,3,6-tetraacetylglucoside (A). 4-Methyl-1,2,3,6-tetraacetylglucoside (B). Glucose, 2-methyl, acetylated. 2,4-Dimethyl-1,3,6-triacetylglucoside (B). 2-Methyl-1,3,4,6-tetraacetylglucoside (A). 2,4-Dimethyl-1,3,6-triacetylglucoside (A). «beta»-D-Glucopyranose, 4-O-(2,3,4,6-tetra-O-acetyl-«alpha»-D-glucopyranosyl)-, tetraacetate. Galactose, alpha,d-,pentaacetate. «alpha»-D-Glucopyranose, pentaacetate. «alpha»-D-Cellobiose octaacetate.

Find more compounds similar to Sucrose Octaacetate.

Sources

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