- InChI
- InChI=1S/C7H12O4/c1-10-6(8)4-3-5-7(9)11-2/h3-5H2,1-2H3
- InChI Key
- XTDYIOOONNVFMA-UHFFFAOYSA-N
- Formula
- C7H12O4
- SMILES
- COC(=O)CCCC(=O)OC
- Molecular Weight1
- 160.17
- CAS
- 1119-40-0
- Other Names
-
- Dimethyl glutarate
- Dimethyl pentanedioate
- Glutaric acid, dimethyl ester
- Methyl glutarate
- 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).
- 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).
- n0 : Refractive Index.
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (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 |
|---|---|---|---|
| ΔcH°solid | -3612.00 | kJ/mol | NIST |
| ΔfG° | -459.78 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -677.41 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 19.46 | kJ/mol | Joback Calculated Property |
| ΔvapH° | [65.70; 66.10] | kJ/mol |
|
| ΔvapH° | 65.70 ± 0.40 | kJ/mol | NIST |
| ΔvapH° | 66.10 | kJ/mol | NIST |
| log10WS | -0.48 | Crippen Calculated Property | |
| logPoct/wat | 0.503 | Crippen Calculated Property | |
| McVol | 124.370 | ml/mol | McGowan Calculated Property |
| Pc | 2770.00 | kPa | Vapor P... |
| Inp | [189.90; 1140.00] |
|
|
| Inp | 1135.00 | NIST | |
| Inp | 1134.00 | NIST | |
| Inp | 1134.00 | NIST | |
| Inp | 1102.00 | NIST | |
| Inp | 1100.00 | NIST | |
| Inp | 1099.00 | NIST | |
| Inp | 1104.00 | NIST | |
| Inp | 1140.00 | NIST | |
| Inp | 1135.00 | NIST | |
| Inp | 1105.00 | NIST | |
| Inp | 1139.80 | NIST | |
| Inp | 1108.00 | NIST | |
| Inp | 1107.00 | NIST | |
| Inp | 1106.00 | NIST | |
| Inp | 1109.00 | NIST | |
| Inp | 1103.00 | NIST | |
| Inp | 1103.00 | NIST | |
| Inp | 1102.00 | NIST | |
| Inp | 1139.00 | NIST | |
| Inp | 1105.00 | NIST | |
| Inp | Outlier 189.90 | NIST | |
| Inp | 1108.00 | NIST | |
| I | [1667.00; 1699.00] |
|
|
| I | 1667.00 | NIST | |
| I | 1690.00 | NIST | |
| I | 1699.00 | NIST | |
| I | 1687.00 | NIST | |
| I | 1687.00 | NIST | |
| I | 1667.00 | NIST | |
| Tboil | [487.20; 487.30] | K |
|
| Tboil | 487.20 | K | Liquid-... |
| Tboil | 487.30 | K | Liquid-... |
| Tc | 697.87 | K | Joback Calculated Property |
| Tfus | 312.97 | K | Joback Calculated Property |
| Vc | 0.475 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [278.30; 335.29] | J/mol×K | [512.14; 697.87] |
|
| Cp,gas | 278.30 | J/mol×K | 512.14 | Joback Calculated Property |
| Cp,gas | 288.74 | J/mol×K | 543.09 | Joback Calculated Property |
| Cp,gas | 298.81 | J/mol×K | 574.05 | Joback Calculated Property |
| Cp,gas | 308.51 | J/mol×K | 605.00 | Joback Calculated Property |
| Cp,gas | 317.83 | J/mol×K | 635.96 | Joback Calculated Property |
| Cp,gas | 326.76 | J/mol×K | 666.91 | Joback Calculated Property |
| Cp,gas | 335.29 | J/mol×K | 697.87 | Joback Calculated Property |
| η | [0.0002482; 0.0020676] | Pa×s | [312.97; 512.14] |
|
| η | 0.0020676 | Pa×s | 312.97 | Joback Calculated Property |
| η | 0.0012258 | Pa×s | 346.17 | Joback Calculated Property |
| η | 0.0007964 | Pa×s | 379.36 | Joback Calculated Property |
| η | 0.0005546 | Pa×s | 412.56 | Joback Calculated Property |
| η | 0.0004076 | Pa×s | 445.75 | Joback Calculated Property |
| η | 0.0003126 | Pa×s | 478.94 | Joback Calculated Property |
| η | 0.0002482 | Pa×s | 512.14 | Joback Calculated Property |
| ΔvapH | 54.70 | kJ/mol | 424.50 | NIST |
| Pvap | [2.00; 63.01] | kPa | [376.09; 463.15] |
|
| Pvap | 2.00 | kPa | 376.09 | Isobari... |
| Pvap | 8.85 | kPa | 393.15 | Vapor-L... |
| Pvap | 5.20 | kPa | 395.80 | Isobari... |
| Pvap | 8.30 | kPa | 407.11 | Isobari... |
| Pvap | 19.14 | kPa | 413.15 | Vapor-L... |
| Pvap | 19.10 | kPa | 413.15 | Vapor-L... |
| Pvap | 25.31 | kPa | 423.15 | Vapor-L... |
| Pvap | 32.89 | kPa | 433.15 | Vapor-L... |
| Pvap | 32.90 | kPa | 433.15 | Vapor-L... |
| Pvap | 41.36 | kPa | 443.15 | Vapor-L... |
| Pvap | 51.72 | kPa | 453.15 | Vapor-L... |
| Pvap | 63.01 | kPa | 463.15 | Vapor-L... |
| n0 | [1.42454; 1.42454] | [293.15; 293.15] |
|
|
| n0 | 1.42454 | 293.15 | Phase e... | |
| n0 | 1.42454 | 293.15 | (Liquid... | |
| n0 | 1.42454 | 293.15 | (Liquid... | |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | [367.20; 376.50] | K | [1.70; 1.90] |
|
| Tboilr | 367.20 | K | 1.70 | NIST |
| Tboilr | 376.50 ± 0.50 | K | 1.90 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.64] | kPa | [366.71; 514.55] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.72297e+01 | |||
| Coefficient B | -5.94230e+03 | |||
| Coefficient C | -1.59650e+01 | |||
| Temperature range, min. | 366.71 | |||
| Temperature range, max. | 514.55 | |||
| Pvap | 1.33 | kPa | 366.71 | Calculated Property |
| Pvap | 2.85 | kPa | 383.14 | Calculated Property |
| Pvap | 5.69 | kPa | 399.56 | Calculated Property |
| Pvap | 10.75 | kPa | 415.99 | Calculated Property |
| Pvap | 19.31 | kPa | 432.42 | Calculated Property |
| Pvap | 33.19 | kPa | 448.84 | Calculated Property |
| Pvap | 54.83 | kPa | 465.27 | Calculated Property |
| Pvap | 87.42 | kPa | 481.70 | Calculated Property |
| Pvap | 135.01 | kPa | 498.12 | Calculated Property |
| Pvap | 202.64 | kPa | 514.55 | Calculated Property |
Similar Compounds
Find more compounds similar to Pentanedioic acid, dimethyl ester.
Mixtures
- Pentanoic acid, 4-oxo- + Pentanedioic acid, dimethyl ester + Water
- Pentanedioic acid, dimethyl ester + Hexanedioic acid, dimethyl ester
- Pentanedioic acid, dimethyl ester + Water
- Butanoic acid + Pentanedioic acid, dimethyl ester + Water
- Pentanedioic acid, dimethyl ester + Propanoic acid + Water
- Pentanedioic acid, dimethyl ester + Butanedioic acid, dimethyl ester
- Pentanedioic acid, dimethyl ester + Acetic acid + Water
- Pentanedioic acid, dimethyl ester + Methyl Alcohol
- Pentanedioic acid, dimethyl ester + Pentanedioic acid
- Formic acid + Pentanedioic acid, dimethyl ester + Water
- Furfural + Pentanedioic acid, dimethyl ester + Water
- Pentanedioic acid, dimethyl ester + Methyl Alcohol + Water
Sources
- Crippen Method
- Crippen Method
- Liquid liquid equilibria of aqueous mixtures containing selected dibasic esters and/or methanol
- Phase equilibria of (water + levulinic acid + dibasic esters) ternary systems
- (Liquid + liquid) equilibria of the (water + carboxylic acid + dibasic esters mixture (DBE-2)) ternary systems
- (Liquid + liquid) equilibria of (water + butyric acid + dibasic esters) ternary systems
- (Liquid + liquid) equilibria of (water + propionic acid + dibasic esters) ternary systems
- Isobaric vapor-liquid equilibrium of three binary systems containing dimethyl succinate, dimethyl glutarate and dimethyl adipate at 2, 5.2 and 8.3 kPa
- Liquid-Liquid Equilibria of Formic Acid and Furfural in a Biphasic Aqueous-Organic System: Optimization of Solvent and Amine Extractant
- Liquid-Liquid Equilibria of Water + Acetic Acid + Dimethyl Glutarate Ternary System
- Vapor Pressures, Enthalpies of Vaporization, and Critical Parameters of a Series of Linear Aliphatic Dimethyl Esters of Dicarboxylic Acids
- Vapor-Liquid Equilibrium of Mixtures Containing Adipic Acid, Glutaric Acid, Dimethyl Adipate, Dimethyl Glutarate, Methanol, and Water
- Liquid-Liquid Equilibria for Ternary Systems of Water + Formic Acid + Dibasic Esters
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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