Chemical Properties of Sorbitol, 2,3,6-trimethyl, acetylated

Sorbitol, 2,3,6-trimethyl, acetylated

InChI
InChI=1S/C15H26O9/c1-9(16)22-8-12(20-5)14(21-6)15(24-11(3)18)13(7-19-4)23-10(2)17/h12-15H,7-8H2,1-6H3/t12-,13+,14-,15-/m0/s1
InChI Key
ATVQUEJOBOKGCC-XGUBFFRZSA-N
Formula
C15H26O9
SMILES
COCC(OC(C)=O)C(OC(C)=O)C(OC)C(COC(C)=O)OC
Molecular Weight1
350.36
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Physical Properties

Property Value Unit Source
ΔfusH° 37.19 kJ/mol Joback Calculated Property
log10WS -0.29 Relay (1.0) Calculated Property
logPoct/wat 0.089 Crippen Calculated Property
McVol 262.140 ml/mol McGowan Calculated Property
Pc 1411.18 kPa Joback Calculated Property
Inp [2250.00; 2251.00]   Show Hide
Inp 2251.00 NIST
Inp 2250.00 NIST
Inp 2251.00 NIST
Tboil 607.07 K Relay (1.0) Calculated Property
Tc 762.09 K Relay (1.0) Calculated Property
Tfus 295.52 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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 [798.19; 868.32] J/mol×K [782.96; 970.40] Show Hide
Cp,gas 798.19 J/mol×K 782.96 Joback Calculated Property
Cp,gas 812.93 J/mol×K 814.20 Joback Calculated Property
Cp,gas 826.49 J/mol×K 845.44 Joback Calculated Property
Cp,gas 838.84 J/mol×K 876.68 Joback Calculated Property
Cp,gas 849.95 J/mol×K 907.92 Joback Calculated Property
Cp,gas 859.79 J/mol×K 939.16 Joback Calculated Property
Cp,gas 868.32 J/mol×K 970.40 Joback Calculated Property
η [0.0000166; 0.0012607] Pa×s [392.49; 782.96] Show Hide
η 0.0012607 Pa×s 392.49 Joback Calculated Property
η 0.0003665 Pa×s 457.57 Joback Calculated Property
η 0.0001449 Pa×s 522.65 Joback Calculated Property
η 0.0000704 Pa×s 587.73 Joback Calculated Property
η 0.0000395 Pa×s 652.80 Joback Calculated Property
η 0.0000246 Pa×s 717.88 Joback Calculated Property
η 0.0000166 Pa×s 782.96 Joback Calculated Property

Similar Compounds

Sorbitol, 2,6-dimethyl, acetylated. Sorbitol, 3,6-dimethyl, acetylated. Sorbitol, 2,3-dimethyl, acetylated. Sorbitol, 2-methyl, acetylated. Sorbitol, 3-methyl, acetylated. Sorbitol, 6-methyl, acetylated. 2,3,6-Tri-O-acetyl-1,5-Anhydro-4-O-methyl-D-mannitol. 2,3-Di-O-acetyl-1,5-anhydro-4,6-di-O-methyl-D-glucitol. 2,3-Di-O-acetyl-1,5-Anhydro-4,6-di-O-methyl-D-mannitol. 2,4-Di-O-acetyl-1,5-Anhydro-3,6-di-O-methyl-D-mannitol. 2,3-Di-O-Acetyl-1,5-Anhydro-4,6-di-O-methyl-D-galactitol. 2,4-Di-O-acetyl-1,5-anhydro-3,6-di-O-methyl-D-glucitol. 2,3,6-Tri-O-acetyl-1,5-anhydro-4-O-methyl-D-glucitol. 2,4-Di-O-Acetyl-1,5-Anhydro-3,6-di-O-methyl-D-galactitol. 2,3,6-Tri-O-Acetyl-1,5-Anhydro-4-O-methyl-D-galactitol.

Find more compounds similar to Sorbitol, 2,3,6-trimethyl, acetylated.

Sources

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