Chemical Properties of 1,4:3,6-Dianhydro-«alpha»-d-glucopyranose

InChI

InChI=1S/C6H8O4/c7-3-5-4-2(1-8-5)9-6(3)10-4/h2-7H,1H2/t2-,3-,4-,5-,6+/m0/s1

InChI Key

XOTJGHCMZOLIPX-GKFJPSPNSA-N

Formula

C6H8O4

SMILES

OC1C2OC3COC1C3O2

Molecular Weight¹

144.13

Other Names

• 1.4:3,6-Dianhydro-A-D-glucopyranose

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I : Polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	35.87	kJ/mol	Joback Calculated Property
logPoct/wat	-1.130		Crippen Calculated Property
McVol	86.300	ml/mol	McGowan Calculated Property
I	[2394.00; 2394.00]
I	2394.00		NIST
I	2394.00		NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[248.04; 305.58]	J/mol×K	[520.79; 721.37]
Cp,gas	248.04	J/mol×K	520.79	Joback Calculated Property
Cp,gas	259.46	J/mol×K	554.22	Joback Calculated Property
Cp,gas	270.07	J/mol×K	587.65	Joback Calculated Property
Cp,gas	279.92	J/mol×K	621.08	Joback Calculated Property
Cp,gas	289.08	J/mol×K	654.51	Joback Calculated Property
Cp,gas	297.61	J/mol×K	687.94	Joback Calculated Property
Cp,gas	305.58	J/mol×K	721.37	Joback Calculated Property
η	[0.0017940; 0.0061025]	Pa×s	[343.25; 520.79]
η	0.0061025	Pa×s	343.25	Joback Calculated Property
η	0.0045891	Pa×s	372.84	Joback Calculated Property
η	0.0035987	Pa×s	402.43	Joback Calculated Property
η	0.0029177	Pa×s	432.02	Joback Calculated Property
η	0.0024300	Pa×s	461.61	Joback Calculated Property
η	0.0020689	Pa×s	491.20	Joback Calculated Property
η	0.0017940	Pa×s	520.79	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,4:3,6-Dianhydro-«alpha»-d-glucopyranose.

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
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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