- InChI
- InChI=1S/C6H10O4/c7-5(8)3-1-2-4-6(9)10/h1-4H2,(H,7,8)(H,9,10)
- InChI Key
- WNLRTRBMVRJNCN-UHFFFAOYSA-N
- Formula
- C6H10O4
- SMILES
- O=C(O)CCCCC(=O)O
- Molecular Weight1
- 146.14
- CAS
- 124-04-9
- Other Names
-
- 1,4-butanedicarboxylic acid
- 1,6-hexanedioic acid
- Adi-pure
- Adipinic acid
- Hexanedioc acid
- Kyselina adipova
- NSC 7622
- acifloctin
- acinetten
- adilactetten
- adipic acid
- asapic
- inipol DS
- ω : Acentric Factor.
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- 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).
- ΔfH°solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔfusH : Enthalpy of fusion at a given temperature (kJ/mol).
- ΔsubH° : Enthalpy of sublimation at standard conditions (kJ/mol).
- ΔsubH : Enthalpy of sublimation at a given temperature (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- ΔvapH : Enthalpy of vaporization at a given temperature (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- NFPA Fire : NFPA Fire Rating.
- Pc : Critical Pressure (kPa).
- Pvap : Vapor pressure (kPa).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- ΔfusS : Entropy of fusion at a given temperature (J/mol×K).
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Ttriple : Triple Point Temperature (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 |
|---|---|---|---|
| ω | 0.8501 | Relay (1.0) Calculated Property | |
| ΔcH°solid | [-2802.40; -2768.70] | kJ/mol |
|
| ΔcH°solid | -2768.70 ± 5.90 | kJ/mol | NIST |
| ΔcH°solid | -2791.98 ± 0.42 | kJ/mol | NIST |
| ΔcH°solid | -2795.90 ± 0.75 | kJ/mol | NIST |
| ΔcH°solid | -2802.40 ± 1.40 | kJ/mol | NIST |
| ΔfG° | -688.18 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -847.52 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfH°solid | [-1021.32; -998.22] | kJ/mol |
|
| ΔfH°solid | -1021.32 | kJ/mol | NIST |
| ΔfH°solid | -998.22 ± 0.42 | kJ/mol | NIST |
| ΔfusH° | [33.70; 38.00] | kJ/mol |
|
| ΔfusH° | 33.70 | kJ/mol | Vaporization, fusion and sublimation enthalpies of the dicarboxylic acids from C4 to C14 and C16 |
| ΔfusH° | 38.00 | kJ/mol | Thermal analysis of phase change materials in the temperature range 120.150 .C |
| ΔsubH° | [129.00; 133.60] | kJ/mol |
|
| ΔsubH° | 133.60 ± 1.30 | kJ/mol | NIST |
| ΔsubH° | 129.00 ± 1.00 | kJ/mol | NIST |
| ΔvapH° | 105.20 | kJ/mol | NIST |
| IE | 10.18 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.82 | Aq. Solubility Prediction | |
| logPoct/wat | 0.716 | Crippen Calculated Property | |
| McVol | 110.280 | ml/mol | McGowan Calculated Property |
| NFPA Fire | 1 | KDB | |
| Pc | 3850.00 | kPa | Critical Temperatures and Pressures of Straight-Chain Saturated Dicarboxylic Acids (C4 to C14) |
| Inp | [1372.40; 1372.40] |
|
|
| Inp | 1372.40 | NIST | |
| Inp | 1372.40 | NIST | |
| I | 2137.00 | NIST | |
| Tboil | 530.95 | K | Relay (1.0) Calculated Property |
| Tc | 747.59 | K | Relay (1.0) Calculated Property |
| Tfus | [422.00; 430.00] | K |
|
| Tfus | 425.50 | K | Solubilities of Adipic Acid in Cyclohexanol + Cyclohexanone Mixtures and Cyclohexanone + Cyclohexane Mixtures |
| Tfus | 424.26 | K | Determination and Thermodynamic Modeling of Solid-Liquid Phase Equilibrium for Succinic Acid in the Glutaric Acid + Adipic Acid + Ethyl Acetate Mixture and Adipic Acid in the Succinic Acid + Glutaric Acid + Ethyl Acetate Mixture |
| Tfus | 425.15 | K | Solubilities of Adipic Acid and Succinic Acid in Glutaric Acid + Acetone or n-butanol Mixture |
| Tfus | 425.95 | K | Aq. Solubility Prediction |
| Tfus | 426.07 ± 0.20 | K | NIST |
| Tfus | 425.50 ± 0.30 | K | NIST |
| Tfus | 425.50 ± 0.30 | K | NIST |
| Tfus | 425.50 ± 0.30 | K | NIST |
| Tfus | 425.50 ± 0.40 | K | NIST |
| Tfus | 425.50 ± 0.30 | K | NIST |
| Tfus | 426.00 ± 1.50 | K | NIST |
| Tfus | 425.50 ± 0.50 | K | NIST |
| Tfus | 422.00 ± 8.00 | K | NIST |
| Tfus | 422.40 ± 1.00 | K | NIST |
| Tfus | Outlier 430.00 ± 2.00 | K | NIST |
| Tfus | 424.00 ± 1.50 | K | NIST |
| Ttriple | [424.70; 424.70] | K |
|
| Ttriple | 424.70 ± 0.30 | K | NIST |
| Ttriple | 424.70 ± 0.30 | K | NIST |
| Vc | 0.421 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| ΔfusH | [33.70; 34.85] | kJ/mol | [419.00; 426.40] |
|
| ΔfusH | 33.70 | kJ/mol | 419.00 | NIST |
| ΔfusH | 34.85 | kJ/mol | 425.50 | NIST |
| ΔfusH | 34.85 | kJ/mol | 426.40 | NIST |
| ΔfusH | 34.85 | kJ/mol | 426.40 | NIST |
| ΔsubH | [125.00; 146.20] | kJ/mol | [296.00; 382.50] |
|
| ΔsubH | 146.20 | kJ/mol | 296.00 | NIST |
| ΔsubH | 140.00 | kJ/mol | 306.50 | NIST |
| ΔsubH | 145.00 ± 4.00 | kJ/mol | 348.00 | NIST |
| ΔsubH | 125.00 ± 20.00 | kJ/mol | 363.00 | NIST |
| ΔsubH | 129.30 ± 2.50 | kJ/mol | 382.50 | NIST |
| ΔsubH | 129.30 ± 2.50 | kJ/mol | 382.50 | NIST |
| ΔvapH | 92.00 | kJ/mol | 521.50 | NIST |
| ΔfusS | 81.92 | J/mol×K | 425.50 | NIST |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 538.20 | K | 13.30 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [160.01; 350.43] | 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 | 6.63400e+00 | |||
| Coefficient B | 6.75400e-01 | |||
| Coefficient C | -4.47800e-04 | |||
| Coefficient D | 1.16200e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 160.01 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 194.67 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 225.11 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 251.67 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 274.74 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 294.67 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 311.84 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 326.61 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 339.35 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 350.43 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0015178; 0.0003274] | Pa×s | [424.96; 582.19] |
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 | -1.21694e+01 | |||
| Coefficient B | 2.41328e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 424.96 | |||
| Temperature range, max. | 582.19 | |||
| η | 0.0015178 | Pa×s | 424.96 | Calculated Property |
| η | 0.0012129 | Pa×s | 442.43 | Calculated Property |
| η | 0.0009859 | Pa×s | 459.90 | Calculated Property |
| η | 0.0008136 | Pa×s | 477.37 | Calculated Property |
| η | 0.0006806 | Pa×s | 494.84 | Calculated Property |
| η | 0.0005763 | Pa×s | 512.31 | Calculated Property |
| η | 0.0004934 | Pa×s | 529.78 | Calculated Property |
| η | 0.0004266 | Pa×s | 547.25 | Calculated Property |
| η | 0.0003722 | Pa×s | 564.72 | Calculated Property |
| η | 0.0003274 | Pa×s | 582.19 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.66] | kPa | [479.40; 639.57] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.76921e+01 | |||
| Coefficient B | -6.86994e+03 | |||
| Coefficient C | -8.46730e+01 | |||
| Temperature range, min. | 479.40 | |||
| Temperature range, max. | 639.57 | |||
| Pvap | 1.33 | kPa | 479.40 | Calculated Property |
| Pvap | 2.83 | kPa | 497.20 | Calculated Property |
| Pvap | 5.63 | kPa | 514.99 | Calculated Property |
| Pvap | 10.61 | kPa | 532.79 | Calculated Property |
| Pvap | 19.05 | kPa | 550.59 | Calculated Property |
| Pvap | 32.77 | kPa | 568.38 | Calculated Property |
| Pvap | 54.24 | kPa | 586.18 | Calculated Property |
| Pvap | 86.74 | kPa | 603.98 | Calculated Property |
| Pvap | 134.46 | kPa | 621.77 | Calculated Property |
| Pvap | 202.66 | kPa | 639.57 | Calculated Property |
| Pvap | [0.08; 102.59] | kPa | [425.50; 611.15] |
KDB Vapor Pressure Data
|
| Equation | ln(Y) = A + B/T + C·ln(T) + D·T² + E/T² Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.33029e+02 | |||
| Coefficient B | -1.71566e+04 | |||
| Coefficient C | -1.58264e+01 | |||
| Coefficient D | 3.22958e-06 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 425.50 | |||
| Temperature range, max. | 611.15 | |||
| Pvap | 0.08 | kPa | 425.50 | Calculated Property |
| Pvap | 0.26 | kPa | 446.13 | Calculated Property |
| Pvap | 0.75 | kPa | 466.76 | Calculated Property |
| Pvap | 1.90 | kPa | 487.38 | Calculated Property |
| Pvap | 4.41 | kPa | 508.01 | Calculated Property |
| Pvap | 9.40 | kPa | 528.64 | Calculated Property |
| Pvap | 18.65 | kPa | 549.27 | Calculated Property |
| Pvap | 34.72 | kPa | 569.89 | Calculated Property |
| Pvap | 61.16 | kPa | 590.52 | Calculated Property |
| Pvap | 102.59 | kPa | 611.15 | Calculated Property |
| Pvap | [0.13; 101.89] | kPa | [432.70; 610.70] |
NIST
|
| Equation | ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.72074e+01 | |||
| Coefficient B | -6.47732e+03 | |||
| Coefficient C | -9.59510e+01 | |||
| Reference | Stull, 1947 | |||
| Temperature range, min. | 432.70 | |||
| Temperature range, max. | 610.70 | |||
| Pvap | 0.13 | kPa | 432.70 | Calculated Property |
| Pvap | 0.38 | kPa | 452.48 | Calculated Property |
| Pvap | 0.99 | kPa | 472.26 | Calculated Property |
| Pvap | 2.35 | kPa | 492.03 | Calculated Property |
| Pvap | 5.11 | kPa | 511.81 | Calculated Property |
| Pvap | 10.37 | kPa | 531.59 | Calculated Property |
| Pvap | 19.78 | kPa | 551.37 | Calculated Property |
| Pvap | 35.75 | kPa | 571.14 | Calculated Property |
| Pvap | 61.63 | kPa | 590.92 | Calculated Property |
| Pvap | 101.89 | kPa | 610.70 | Calculated Property |
Similar Compounds
Find more compounds similar to Hexanedioic acid.
Mixtures
- Hexanedioic acid + Ethanol
- Hexanedioic acid + Acetic acid
- Hexanedioic acid + Acetone
- Hexanedioic acid + Ethyl Acetate
- Hexanedioic acid + Water
- Hexanedioic acid + Acetic acid + Water
- Cyclohexanol + Hexanedioic acid
- Hexanedioic acid + Cyclohexanone
- Cyclohexanol + Hexanedioic acid + Cyclohexane
- Hexanedioic acid + Cyclohexanone + Cyclohexane
- Cyclohexanol + Hexanedioic acid + Cyclohexanone
- Hexanedioic acid + Ethanol + Pentanedioic acid
- Hexanedioic acid + Propanoic acid + Water
- Hexanedioic acid + Propanoic acid
- Hexanedioic acid + Ethanol, 2,2'-oxybis-
- Hexanedioic acid + Urea + Ethanol, 2,2'-oxybis-
- Hexanedioic acid + Ethyl Acetate + Pentanedioic acid
- Hexanedioic acid + Acetic acid + Cyclohexanone
- Hexanedioic acid + Urea + Water
- Hexanedioic acid + 2-Oxepanone + Acetic acid
Find more mixtures with Hexanedioic acid.
Sources
- KDB Vapor Pressure Data
- Cheméo Relay (1.0)
- Crippen Method
- Measurement on the solubility of adipic acid in various solvents at high temperature and its thermodynamics parameters.
- Determination and correlation of solid-liquid phase equilibrium and phase diagram for multicomponent system of mixed dibasic acids. (I) Ternary system of adipic acid + glutaric acid + ethanol system
- Determination and modeling of binary and ternary solid-liquid phase equilibrium for the systems formed by adipic acid, urea and diethylene glycol
- Solubilities of adipic acid in binary cyclohexanone + cyclohexanol, cyclohexane + cyclohexanol, and cyclohexane + cyclohexanone solvent mixtures
- Vaporization, fusion and sublimation enthalpies of the dicarboxylic acids from C4 to C14 and C16
- An odd-even effect on solubility of dicarboxylic acids in organic solvents
- Solubility and thermodynamics of vitamin C in binary liquid mixtures involving water, methanol, ethanol and isopropanol at different temperatures
- Solubility of succinic acid, glutaric acid and adipic acid in propionic acid + epsilon-caprolactone + water mixtures: Experimental measurement and thermodynamic modeling
- Thermal analysis of phase change materials in the temperature range 120.150 .C
- Solubilities of Adipic Acid in Cyclohexanol + Cyclohexanone Mixtures and Cyclohexanone + Cyclohexane Mixtures
- Determination and Correlation of Solid Liquid Phase Equilibrium and Phase Diagram for a Multicomponent System of Mixed Dibasic Acids. Ternary System of Succinic Acid + Adipic Acid + Ethanol
- Determination and Correlation of Solubilities for Succinic Acid in the Adipic Acid + Glutaric Acid + Acetone Mixture and Adipic Acid in the Succinic Acid + Glutaric Acid + Acetone Mixture
- Measurement and Correlation for Solubilities of Adipic Acid in Acetic Acid + e-Caprolactone Mixtures and Cyclohexanone + e-Caprolactone Mixtures
- Measurement and Correlation for Solubilities of Adipic Acid, Glutaric Acid and Succinic Acid in Acetic Acid + Cyclohexanone Mixtures
- Measurement and Correlation for Solubilities of Adipic Acid, Glutaric Acid, and Succinic Acid in Dimethyl Adipate + Methanol Mixtures
- Measurement and Correlation for the Solubility of Adipic Acid and Succinic Acid in Glutaric Acid + Cyclohexanone and Glutaric Acid + Acetic Acid Mixtures
- Determination and Thermodynamic Modeling of Solid-Liquid Phase Equilibrium for Succinic Acid in the Glutaric Acid + Adipic Acid + Ethyl Acetate Mixture and Adipic Acid in the Succinic Acid + Glutaric Acid + Ethyl Acetate Mixture
- Phase Equilibrium Involving Xylose, Water, and Ethylene Glycol or 1,2-Propylene Glycol at Different Temperatures
- Critical Temperatures and Pressures of Straight-Chain Saturated Dicarboxylic Acids (C4 to C14)
- Viscosity B Coefficients and Activation Parameters of Viscous Flow for Hexanedioic Acid in Aqueous Dextran Solution
- Solubilities of Adipic Acid in Acetic Acid + Water Mixtures and Acetic Acid + Cyclohexane Mixtures
- Solid Liquid Equilibrium and Phase Diagram for the Ternary Succinic Acid + Glutaric Acid + Water System
- Solubilities of Adipic Acid and Succinic Acid in Glutaric Acid + Acetone or n-butanol Mixture
- Ternary Phase Diagram for Systems of Succinic Acid + Urea + Water, Glutaric Acid + Urea + Water and Adipic Acid + Urea + Water at 288.15 K and 303.15 K
- Solubility of Adipic Acid in Acetone, Chloroform, and Toluene
- Joback Method
- KDB
- Aqueous Solubility Prediction Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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