Chemical Properties of Glucose, 2,3,6-trimethyl, nitrile, acetylated

Glucose, 2,3,6-trimethyl, nitrile, acetylated

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InChI
InChI=1S/C13H21NO7/c1-8(15)20-11(7-17-3)13(21-9(2)16)12(19-5)10(6-14)18-4/h10-13H,7H2,1-5H3/t10-,11+,12+,13+/m0/s1
InChI Key
ZRJVYQQKDYYEET-UMSGYPCISA-N
Formula
C13H21NO7
SMILES
COCC(OC(C)=O)C(OC(C)=O)C(OC)C(C#N)OC
Molecular Weight1
303.31
Sources

Physical Properties

Property Value Unit Source
Δf -600.84 kJ/mol Joback Calculated Property
Δfgas -1054.15 kJ/mol Joback Calculated Property
Δfus 25.98 kJ/mol Joback Calculated Property
Δvap 79.00 kJ/mol Joback Calculated Property
logPoct/wat 0.05 Crippen Calculated Property
Pc 1710.36 kPa Joback Calculated Property
Tboil 817.00 K Joback Calculated Property
Tc 1017.55 K Joback Calculated Property
Tfus 452.27 K Joback Calculated Property
Vc 0.87 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 683.69 J/mol×K 817.0 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 4
-CN 1
-O- (nonring) 5
>C=O (nonring) 2
-CH2- 1
-CH3 5

Similar Compounds

Glucose, 2,3-dimethyl, nitrile, acetylated. Glucose, 2,6-dimethyl, nitrile, acetylated. Glucose, 2,3,6-triethyl, nitrile, acetylated. Glucose, 2,3-diethyl, nitrile, acetylated. Glucose, 2-methyl, nitrile, acetylated. Glucose, 3-methyl, nitrile, acetylated. Glucose, 3,6-dimethyl, nitrile, acetylated. Glucose, 2-ethyl, nitrile, acetylated. Glucose, 2,6-diethyl, nitrile, acetylated. Glucose, 3,6-diethyl, nitrile, acetylated. Glucose, 3-ethyl, nitrile, acetylated. Glucose, 6-ethyl, nitrile, acetylated. Glucose, nitrile, acetylated. D-Allose, aldononitrile, pentaacetate. D-(+)-Talose, aldononitrile, pentaacetate.

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

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