Chemical Properties of L-arabinose, acetylated diethyldithioacetal derivative

L-arabinose, acetylated diethyldithioacetal derivative

InChI
InChI=1S/C17H28O8S2/c1-7-26-17(27-8-2)16(25-13(6)21)15(24-12(5)20)14(23-11(4)19)9-22-10(3)18/h14-17H,7-9H2,1-6H3/t14-,15-,16+/m0/s1
InChI Key
OGSWVSGRSHUBOP-HRCADAONSA-N
Formula
C17H28O8S2
SMILES
CCSC(SCC)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](COC(C)=O)OC(C)=O
Molecular Weight1
424.54
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfusH° 51.43 kJ/mol Joback Calculated Property
log10WS -2.08 Relay (1.0) Calculated Property
logPoct/wat 2.177 Crippen Calculated Property
McVol 312.850 ml/mol McGowan Calculated Property
Inp 2252.00 NIST
Tboil 647.09 K Relay (1.0) Calculated Property
Tfus 309.80 K Relay (1.0) Calculated Property

Cheméo can also estimate 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [471.21; 984.14] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A1.21543e+02
Coefficient B1.41210e+00
Coefficient C-4.55000e-04
Coefficient D-9.45000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 471.21 J/mol×K 273.00 Calculated Property
Cp,gas 559.98 J/mol×K 353.78 Calculated Property
Cp,gas 641.50 J/mol×K 434.56 Calculated Property
Cp,gas 715.48 J/mol×K 515.33 Calculated Property
Cp,gas 781.61 J/mol×K 596.11 Calculated Property
Cp,gas 839.60 J/mol×K 676.89 Calculated Property
Cp,gas 889.15 J/mol×K 757.67 Calculated Property
Cp,gas 929.95 J/mol×K 838.44 Calculated Property
Cp,gas 961.72 J/mol×K 919.22 Calculated Property
Cp,gas 984.14 J/mol×K 1000.00 Calculated Property

Similar Compounds

D-xylose, acetylated diethyldithioacetal derivative. D-glucose, acetylated diethyldithioacetal derivative. D-galactose, acetylated diethyldithioacetal derivative. D-mannose, acetylated diethyldithioacetal derivative. L-fucose, acetylated diethyldithioacetal derivative. L-rhamnose, acetylated diethyldithioacetal derivative. 1H-pyrazolo[3,4-d]pyrimidine, 4-(methylthio)-1-beta-d-ribofuranosyl-, 2',3',5'-tribenzoate. xanthosine-5'-monophosphate, TMS. Quinine, trimethylsilyl ether. 1H-Indole-3-ethanol, 2-(5-ethenyl-1-azabicyclo[2.2.2]oct-2-yl)-, [1S-(1«alpha»,2«alpha»,4«alpha»,5«beta»)]-. Thymidine, 3'-O-acetyl, 5'-O-TBDMS. 9H-purine-6(1h)-thione, 9-beta-d-ribofuranosyl-, 2',3'-diacetate, 5'-bis(3,5-dimethylphenyl)phosphate. mithramycin a. risperidone. inosine-5'-monophosphate, TMS.

Find more compounds similar to L-arabinose, acetylated diethyldithioacetal derivative.

Sources

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.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
These property values are available through the Cheméo API. A free account gives you an access key.