- InChI
- InChI=1S/C14H26O4/c1-3-17-13(15)11-9-7-5-6-8-10-12-14(16)18-4-2/h3-12H2,1-2H3
- InChI Key
- ONKUXPIBXRRIDU-UHFFFAOYSA-N
- Formula
- C14H26O4
- SMILES
- CCOC(=O)CCCCCCCCC(=O)OCC
- Molecular Weight1
- 258.35
- CAS
- 110-40-7
- Other Names
-
- Bisoflex DES
- Decanedioic acid, 1,10-diethyl ester
- Diethyl 1,10-decanedioate
- Diethyl decanedioate
- Diethyl sebacate
- Ethyl sebacate
- NSC 8911
- Sebacic acid, diethyl ester
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Pvap : Vapor pressure (kPa).
- ρl : Liquid Density (kg/m3).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | -400.84 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -821.89 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.59 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 65.07 | kJ/mol | Joback Calculated Property |
| log10WS | -3.51 | Aq. Sol... | |
| logPoct/wat | 3.233 | Crippen Calculated Property | |
| McVol | 223.000 | ml/mol | McGowan Calculated Property |
| Pc | 1639.10 | kPa | Joback Calculated Property |
| Inp | [1745.00; 1804.00] |
|
|
| Inp | 1804.00 | NIST | |
| Inp | 1746.00 | NIST | |
| Inp | 1759.00 | NIST | |
| Inp | 1764.00 | NIST | |
| Inp | 1759.00 | NIST | |
| Inp | 1752.00 | NIST | |
| Inp | 1746.00 | NIST | |
| Inp | 1745.00 | NIST | |
| Inp | 1804.00 | NIST | |
| I | 2272.00 | NIST | |
| Tboil | 585.20 | K | NIST |
| Tc | 740.00 | K | Vapor-l... |
| Tfus | 276.65 | K | Aq. Sol... |
| Vc | 0.868 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [622.19; 705.29] | J/mol×K | [672.30; 848.26] |
|
| Cp,gas | 622.19 | J/mol×K | 672.30 | Joback Calculated Property |
| Cp,gas | 637.83 | J/mol×K | 701.63 | Joback Calculated Property |
| Cp,gas | 652.75 | J/mol×K | 730.95 | Joback Calculated Property |
| Cp,gas | 666.95 | J/mol×K | 760.28 | Joback Calculated Property |
| Cp,gas | 680.44 | J/mol×K | 789.61 | Joback Calculated Property |
| Cp,gas | 693.22 | J/mol×K | 818.93 | Joback Calculated Property |
| Cp,gas | 705.29 | J/mol×K | 848.26 | Joback Calculated Property |
| η | [0.0001198; 0.0014859] | Pa×s | [391.86; 672.30] |
|
| η | 0.0014859 | Pa×s | 391.86 | Joback Calculated Property |
| η | 0.0007810 | Pa×s | 438.60 | Joback Calculated Property |
| η | 0.0004646 | Pa×s | 485.34 | Joback Calculated Property |
| η | 0.0003028 | Pa×s | 532.08 | Joback Calculated Property |
| η | 0.0002115 | Pa×s | 578.82 | Joback Calculated Property |
| η | 0.0001558 | Pa×s | 625.56 | Joback Calculated Property |
| η | 0.0001198 | Pa×s | 672.30 | Joback Calculated Property |
| ΔvapH | 74.10 | kJ/mol | 488.50 | NIST |
| ρl | 959.18 | kg/m3 | 298.20 | Modelin... |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.63] | kPa | [445.42; 616.82] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.74579e+01 | |||
| Coefficient B | -7.11540e+03 | |||
| Coefficient C | -3.10220e+01 | |||
| Temperature range, min. | 445.42 | |||
| Temperature range, max. | 616.82 | |||
| Pvap | 1.33 | kPa | 445.42 | Calculated Property |
| Pvap | 2.83 | kPa | 464.46 | Calculated Property |
| Pvap | 5.66 | kPa | 483.51 | Calculated Property |
| Pvap | 10.68 | kPa | 502.55 | Calculated Property |
| Pvap | 19.18 | kPa | 521.60 | Calculated Property |
| Pvap | 32.97 | kPa | 540.64 | Calculated Property |
| Pvap | 54.53 | kPa | 559.69 | Calculated Property |
| Pvap | 87.07 | kPa | 578.73 | Calculated Property |
| Pvap | 134.73 | kPa | 597.78 | Calculated Property |
| Pvap | 202.63 | kPa | 616.82 | Calculated Property |
Similar Compounds
Find more compounds similar to Decanedioic acid, diethyl ester.
Mixtures
- Decanedioic acid, diethyl ester + Formic acid + Water
- Decanedioic acid, diethyl ester + Oxalic acid + Water
Sources
- Crippen Method
- Modeling phase equilibria of ternary systems (water + formic acid + ester or alcohol) through UNIFAC-original, SERLAS, NRTL, NRTL-modified, and three-suffix Margules: Parameter estimation using genetic algorithm
- Vapor-liquid critical temperatures and pressures of dicarboxylic acid diethyl esters
- Comparison of Extractability of Oxalic Acid from Dilute Aqueous Solutions Using Dioctylamine and Trioctylphosphine Oxide
- Joback Method
- Aqueous Solubility Prediction Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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