Chemical Properties of Sorbitol, 3,6-dimethyl, acetylated

Sorbitol, 3,6-dimethyl, acetylated

InChI
InChI=1S/C16H26O10/c1-9(17)23-8-14(25-11(3)19)15(22-6)16(26-12(4)20)13(7-21-5)24-10(2)18/h13-16H,7-8H2,1-6H3/t13-,14+,15+,16+/m0/s1
InChI Key
BWFYMIDEWZXNAH-UGUYLWEFSA-N
Formula
C16H26O10
SMILES
COC[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](OC)[C@@H](COC(C)=O)OC(C)=O
Molecular Weight1
378.37
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Physical Properties

Property Value Unit Source
ΔfusH° 42.96 kJ/mol Joback Calculated Property
log10WS -0.58 Relay (1.0) Calculated Property
logPoct/wat 0.006 Crippen Calculated Property
McVol 277.800 ml/mol McGowan Calculated Property
Pc 1335.88 kPa Joback Calculated Property
Inp [2128.00; 2134.00]   Show Hide
Inp 2134.00 NIST
Inp 2128.00 NIST
Inp 2134.00 NIST
Tboil 621.40 K Relay (1.0) Calculated Property
Tc 783.62 K Relay (1.0) Calculated Property
Tfus 316.02 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 [866.51; 922.71] J/mol×K [841.64; 1036.36] Show Hide
Cp,gas 866.51 J/mol×K 841.64 Joback Calculated Property
Cp,gas 879.57 J/mol×K 874.09 Joback Calculated Property
Cp,gas 891.20 J/mol×K 906.55 Joback Calculated Property
Cp,gas 901.36 J/mol×K 939.00 Joback Calculated Property
Cp,gas 910.02 J/mol×K 971.45 Joback Calculated Property
Cp,gas 917.15 J/mol×K 1003.90 Joback Calculated Property
Cp,gas 922.71 J/mol×K 1036.36 Joback Calculated Property
η [0.0000114; 0.0009411] Pa×s [423.86; 841.64] Show Hide
η 0.0009411 Pa×s 423.86 Joback Calculated Property
η 0.0002682 Pa×s 493.49 Joback Calculated Property
η 0.0001042 Pa×s 563.12 Joback Calculated Property
η 0.0000499 Pa×s 632.75 Joback Calculated Property
η 0.0000276 Pa×s 702.38 Joback Calculated Property
η 0.0000170 Pa×s 772.01 Joback Calculated Property
η 0.0000114 Pa×s 841.64 Joback Calculated Property

Similar Compounds

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

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

Sources

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