![[1,4]Dioxino[2,3-b]-1,4-dioxin, hexahydro-](/cid/55-489-9/1-4-Dioxino-2-3-b-1-4-dioxin-hexahydro.png "[1,4]Dioxino[2,3-b]-1,4-dioxin, hexahydro-")
- InChI
- InChI=1S/C6H10O4/c1-2-8-6-5(7-1)9-3-4-10-6/h5-6H,1-4H2
- InChI Key
- XIEQDDLBXUOZOD-UHFFFAOYSA-N
- Formula
- C6H10O4
- SMILES
- C1COC2OCCOC2O1
- Molecular Weight1
- 146.14
- Other Names
-
- p-Dioxino[2,3-b]-p-dioxin, hexahydro-
- Ethanedial, cyclic 1,2:1,2-bis(1,2-ethanediyl acetal)
- Naphthodioxane
- 1,4,5,8-Naphthodioxane
- 1,4,5,8-Tetraoxaperhydronaphthalene
- 1,4,5,8-Tetraoxa-decalin
- 1,4,5,8-Tetraoxabicyclo[4.4.0]decane
- Hexahydro[1,4]dioxino[2,3-b][1,4]dioxine
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Ip : Polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -599.52 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 31.08 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 62.00 | kJ/mol | Relay (1.0) Calculated Property |
| IE | [8.50; 9.22] | eV |
|
| IE | 8.50 | eV | NIST |
| IE | 9.22 | eV | NIST |
| logPoct/wat | -0.268 | Crippen Calculated Property | |
| McVol | 97.160 | ml/mol | McGowan Calculated Property |
| Ip | [1827.00; 1827.00] |
|
|
| Ip | 1827.00 | NIST | |
| Ip | 1827.00 | NIST | |
| Tboil | 487.34 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, 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.
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [135.76; 373.55] | 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 | -5.42500e+01 | |||
| Coefficient B | 8.25200e-01 | |||
| Coefficient C | -5.01800e-04 | |||
| Coefficient D | 1.04400e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 135.76 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 179.51 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 218.15 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 252.03 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 281.46 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 306.78 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 328.32 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 346.41 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 361.38 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 373.55 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0061087; 0.0005688] | Pa×s | [285.46; 494.13] |
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 | -1.07194e+01 | |||
| Coefficient B | 1.60468e+03 | |||
| 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. | 285.46 | |||
| Temperature range, max. | 494.13 | |||
| η | 0.0061087 | Pa×s | 285.46 | Calculated Property |
| η | 0.0040046 | Pa×s | 308.65 | Calculated Property |
| η | 0.0027848 | Pa×s | 331.83 | Calculated Property |
| η | 0.0020306 | Pa×s | 355.02 | Calculated Property |
| η | 0.0015392 | Pa×s | 378.20 | Calculated Property |
| η | 0.0012046 | Pa×s | 401.39 | Calculated Property |
| η | 0.0009684 | Pa×s | 424.57 | Calculated Property |
| η | 0.0007962 | Pa×s | 447.76 | Calculated Property |
| η | 0.0006674 | Pa×s | 470.94 | Calculated Property |
| η | 0.0005688 | Pa×s | 494.13 | Calculated Property |
Similar Compounds
Find more compounds similar to [1,4]Dioxino[2,3-b]-1,4-dioxin, hexahydro-.
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
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