Chemical Properties of D-cellobiose (CAS 528-50-7)

InChI

InChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3-,4-,5-,6+,7-,8-,9-,10-,11-,12+/m0/s1

InChI Key

GUBGYTABKSRVRQ-BPUYHBCVSA-N

Formula

C12H22O11

SMILES

OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O

Molecular Weight¹

342.30

CAS

528-50-7

Other Names

• 4-O-.beta.-D-glucopyranosyl-D-glucose
• D-(+)-cellobiose
• D-glucose, 4-O-.beta.-D-glucopyranosyl-
• cellobiose
• cellose

• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• C_p,solid : Solid phase heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_subH : Enthalpy of sublimation at a given temperature (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

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 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,solid	[407.80; 534.80]	J/mol×K	[288.15; 358.15]
Cp,solid	407.80	J/mol×K	288.15	Temperature dependence of the heat capacities in the solid state of 18 mono-, di-, and poly-saccharides
Cp,solid	431.00	J/mol×K	293.15	Temperature dependence of the heat capacities in the solid state of 18 mono-, di-, and poly-saccharides
Cp,solid	436.10	J/mol×K	298.15	Temperature dependence of the heat capacities in the solid state of 18 mono-, di-, and poly-saccharides
Cp,solid	445.00	J/mol×K	303.15	Temperature dependence of the heat capacities in the solid state of 18 mono-, di-, and poly-saccharides
Cp,solid	443.10	J/mol×K	308.15	Temperature dependence of the heat capacities in the solid state of 18 mono-, di-, and poly-saccharides
Cp,solid	446.90	J/mol×K	313.15	Temperature dependence of the heat capacities in the solid state of 18 mono-, di-, and poly-saccharides
Cp,solid	448.70	J/mol×K	318.15	Temperature dependence of the heat capacities in the solid state of 18 mono-, di-, and poly-saccharides
Cp,solid	463.20	J/mol×K	323.15	Temperature dependence of the heat capacities in the solid state of 18 mono-, di-, and poly-saccharides
Cp,solid	463.50	J/mol×K	328.15	Temperature dependence of the heat capacities in the solid state of 18 mono-, di-, and poly-saccharides
Cp,solid	473.10	J/mol×K	333.15	Temperature dependence of the heat capacities in the solid state of 18 mono-, di-, and poly-saccharides
Cp,solid	481.10	J/mol×K	338.15	Temperature dependence of the heat capacities in the solid state of 18 mono-, di-, and poly-saccharides
Cp,solid	490.70	J/mol×K	343.15	Temperature dependence of the heat capacities in the solid state of 18 mono-, di-, and poly-saccharides
Cp,solid	503.20	J/mol×K	348.15	Temperature dependence of the heat capacities in the solid state of 18 mono-, di-, and poly-saccharides
Cp,solid	515.80	J/mol×K	353.15	Temperature dependence of the heat capacities in the solid state of 18 mono-, di-, and poly-saccharides
Cp,solid	534.80	J/mol×K	358.15	Temperature dependence of the heat capacities in the solid state of 18 mono-, di-, and poly-saccharides
ΔsubH	302.00 ± 44.00	kJ/mol	481.00	NIST

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[352.07; 868.75]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			1.07520e+01
Coefficient B			1.37880e+00
Coefficient C			-4.52200e-04
Coefficient D			-6.86000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	352.07	J/mol×K	273.00	Calculated Property
Cp,gas	438.91	J/mol×K	353.78	Calculated Property
Cp,gas	518.90	J/mol×K	434.56	Calculated Property
Cp,gas	591.82	J/mol×K	515.33	Calculated Property
Cp,gas	657.45	J/mol×K	596.11	Calculated Property
Cp,gas	715.58	J/mol×K	676.89	Calculated Property
Cp,gas	766.00	J/mol×K	757.67	Calculated Property
Cp,gas	808.47	J/mol×K	838.44	Calculated Property
Cp,gas	842.80	J/mol×K	919.22	Calculated Property
Cp,gas	868.75	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[2.0238363e-08; 1.7651509e-11]	Pa×s	[767.77; 1248.87]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-3.60023e+01
Coefficient B			1.40399e+04
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			767.77
Temperature range, max.			1248.87
η	2.0238363e-08	Pa×s	767.77	Calculated Property
η	6.1549854e-09	Pa×s	821.23	Calculated Property
η	2.1650324e-09	Pa×s	874.68	Calculated Property
η	8.5895437e-10	Pa×s	928.14	Calculated Property
η	3.7688150e-10	Pa×s	981.59	Calculated Property
η	1.8005011e-10	Pa×s	1035.05	Calculated Property
η	9.2489300e-11	Pa×s	1088.50	Calculated Property
η	5.0567817e-11	Pa×s	1141.96	Calculated Property
η	2.9181533e-11	Pa×s	1195.41	Calculated Property
η	1.7651509e-11	Pa×s	1248.87	Calculated Property

Similar Compounds

Find more compounds similar to D-cellobiose.

Mixtures

• D-cellobiose + Glycine + Water
• D-cellobiose + Water
• Magnesium chloride + D-cellobiose + Water
• potassium chloride + D-cellobiose + Water
• D-cellobiose + Water + Acetic acid, sodium salt, hydrate (1:1:3)
• Ammonium sulfate + D-cellobiose + Water
• Lithium chloride + D-cellobiose + Water
• Potassium phosphate, monobasic + D-cellobiose + Water
• D-Alanine + D-cellobiose + Water
• D-Valine + D-cellobiose + Water
• D-Leucine + D-cellobiose + Water
• D-cellobiose + Water + Sodium borate

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Modulation in physico-chemical characteristics of some polyhydroxy solutes in presence of L-glycine: Volumetric and NMR spectroscopic approach
• Apparent molar volumes and apparent molar heat capacities of aqueous D(+)-cellobiose, D(+)-maltose, and sucrose at temperatures from 278.15 K to 393.15 K and at the pressure 0.35 MPa
• Temperature dependence of the heat capacities in the solid state of 18 mono-, di-, and poly-saccharides
• Studies on volumetric properties of some saccharides in aqueous potassium chloride solutions over temperature range (288.15 to 318.15) K
• Effect of sodium acetate on the volumetric behaviour of some mono-, di-, and tri-saccharides in aqueous solutions over temperature range (288.15 to 318.15) K
• Viscometric studies on saccharides in aqueous magnesium chloride solutions at T = (288.15 to 318.15) K
• Rheological and time domain 1H NMR relaxation studies of some polyhydroxy solutes in presence of L-glycine
• Viscosities of Some Saccharides in Aqueous Solutions of Phosphate-Based Inorganic Salts
• Solid Liquid Equilibrium of Cellobiose, Sucrose, and Maltose Monohydrate in Ionic Liquids: Experimental and Quantum Chemical Insights
• Thermodynamic Study of Some Amino Acids, 2-Aminopropanoic Acid, 2-Amino-3-methylbutanoic Acid, 2-Amino-4-methylpentanoic Acid, and 2-Amino-3-phenylpropanoic Acid in Aqueous Saccharide Solutions at Different Temperatures: Volumetric and Ultrasonic Study
• Volumetric and Viscometric Studies on Saccharide-Disodium Tetraborate (Borax) Interactions in Aqueous Solutions
• Studies on the Interactions of Saccharides and Methyl Glycosides with Lithium Chloride in Aqueous Solutions at (288.15 to 318.15) K
• Volumetric Properties of Disaccharides in Aqueous Solutions of Benzyldimethylammonium Acetate as a Function of Temperature
• Thermodynamic and Transport Properties of Some Disaccharides in Aqueous Ammonium Sulfate Solutions at Various Temperatures
• Joback Method
• McGowan Method
• NIST Webbook

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