- InChI
- InChI=1S/C12H22O4/c1-3-5-9-15-11(13)7-8-12(14)16-10-6-4-2/h3-10H2,1-2H3
- InChI Key
- YUXIBTJKHLUKBD-UHFFFAOYSA-N
- Formula
- C12H22O4
- SMILES
- CCCCOC(=O)CCC(=O)OCCCC
- Molecular Weight1
- 230.30
- CAS
- 141-03-7
- Other Names
-
- B-9
- Butanedioic acid, 1,4-dibutyl ester
- Butyl butanedioate
- DNBS
- Di-n-butylester kyseliny jantarove
- Dibutyl butanedioate
- ENT 666
- NSC 1502
- Succinic acid di-n-butyl ester
- Tabatrex
- Tabutrex
- di-n-butyl succinate
- dibutyl succinate
- succinic acid, dibutyl ester
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- Cp,liquid : Liquid phase 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).
- ΔfusH : Enthalpy of fusion at a given temperature (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (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.
- ΔfusS : Entropy of fusion at a given temperature (J/mol×K).
- S°liquid : Liquid phase molar entropy at standard conditions (J/mol×K).
- 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° | -417.68 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -780.61 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 32.41 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.62 | kJ/mol | Joback Calculated Property |
| log10WS | -2.57 | Crippen Calculated Property | |
| logPoct/wat | 2.453 | Crippen Calculated Property | |
| McVol | 194.820 | ml/mol | McGowan Calculated Property |
| Pc | 1927.05 | kPa | Joback Calculated Property |
| Inp | [1526.00; 1560.00] |
|
|
| Inp | 1560.00 | NIST | |
| Inp | 1529.00 | NIST | |
| Inp | 1528.00 | NIST | |
| Inp | 1528.00 | NIST | |
| Inp | 1528.00 | NIST | |
| Inp | 1560.00 | NIST | |
| Inp | 1526.00 | NIST | |
| Inp | 1534.00 | NIST | |
| I | 2000.00 | NIST | |
| S°liquid | 548.44 | J/mol×K | NIST |
| Tboil | [408.00; 547.70] | K |
|
| Tboil | 408.00 ± 6.00 | K | NIST |
| Tboil | 547.70 ± 1.00 | K | NIST |
| Tc | 803.91 | K | Joback Calculated Property |
| Tfus | 369.32 | K | Joback Calculated Property |
| Vc | 0.755 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [515.96; 593.78] | J/mol×K | [626.54; 803.91] |
|
| Cp,gas | 515.96 | J/mol×K | 626.54 | Joback Calculated Property |
| Cp,gas | 530.51 | J/mol×K | 656.10 | Joback Calculated Property |
| Cp,gas | 544.42 | J/mol×K | 685.66 | Joback Calculated Property |
| Cp,gas | 557.71 | J/mol×K | 715.23 | Joback Calculated Property |
| Cp,gas | 570.37 | J/mol×K | 744.79 | Joback Calculated Property |
| Cp,gas | 582.39 | J/mol×K | 774.35 | Joback Calculated Property |
| Cp,gas | 593.78 | J/mol×K | 803.91 | Joback Calculated Property |
| Cp,liquid | 436.24 | J/mol×K | 298.15 | NIST |
| η | [0.0001522; 0.0017118] | Pa×s | [369.32; 626.54] |
|
| η | 0.0017118 | Pa×s | 369.32 | Joback Calculated Property |
| η | 0.0009273 | Pa×s | 412.19 | Joback Calculated Property |
| η | 0.0005638 | Pa×s | 455.06 | Joback Calculated Property |
| η | 0.0003735 | Pa×s | 497.93 | Joback Calculated Property |
| η | 0.0002641 | Pa×s | 540.80 | Joback Calculated Property |
| η | 0.0001965 | Pa×s | 583.67 | Joback Calculated Property |
| η | 0.0001522 | Pa×s | 626.54 | Joback Calculated Property |
| ΔfusH | [29.21; 29.21] | kJ/mol | [244.10; 244.13] |
|
| ΔfusH | 29.21 | kJ/mol | 244.10 | NIST |
| ΔfusH | 29.21 | kJ/mol | 244.10 | NIST |
| ΔfusH | 29.21 | kJ/mol | 244.13 | NIST |
| Pvap | [1.32e-03; 0.05] | kPa | [313.30; 358.20] |
|
| Pvap | 1.32e-03 | kPa | 313.30 | Vapor P... |
| Pvap | 1.70e-03 | kPa | 316.20 | Vapor P... |
| Pvap | 2.05e-03 | kPa | 318.30 | Vapor P... |
| Pvap | 2.48e-03 | kPa | 320.20 | Vapor P... |
| Pvap | 3.25e-03 | kPa | 323.20 | Vapor P... |
| Pvap | 3.83e-03 | kPa | 325.20 | Vapor P... |
| Pvap | 4.89e-03 | kPa | 328.20 | Vapor P... |
| Pvap | 5.77e-03 | kPa | 330.20 | Vapor P... |
| Pvap | 7.43e-03 | kPa | 333.20 | Vapor P... |
| Pvap | 8.77e-03 | kPa | 335.40 | Vapor P... |
| Pvap | 0.01 | kPa | 338.20 | Vapor P... |
| Pvap | 0.01 | kPa | 340.10 | Vapor P... |
| Pvap | 0.02 | kPa | 343.20 | Vapor P... |
| Pvap | 0.02 | kPa | 346.20 | Vapor P... |
| Pvap | 0.02 | kPa | 349.20 | Vapor P... |
| Pvap | 0.03 | kPa | 352.10 | Vapor P... |
| Pvap | 0.04 | kPa | 355.10 | Vapor P... |
| Pvap | 0.05 | kPa | 358.20 | Vapor P... |
| ρl | [938.70; 975.30] | kg/m3 | [293.15; 333.15] |
|
| ρl | 975.30 | kg/m3 | 293.15 | Solubil... |
| ρl | 966.20 | kg/m3 | 303.15 | Solubil... |
| ρl | 957.00 | kg/m3 | 313.15 | Solubil... |
| ρl | 947.80 | kg/m3 | 323.15 | Solubil... |
| ρl | 938.70 | kg/m3 | 333.15 | Solubil... |
| ΔfusS | 119.60 | J/mol×K | 244.13 | NIST |
Similar Compounds
Find more compounds similar to Butanedioic acid, dibutyl ester.
Mixtures
- Sulfur dioxide + Butanedioic acid, dibutyl ester
- 1-Butanol + Butanedioic acid, dibutyl ester
- Acetonitrile + Butanedioic acid, dibutyl ester
- Tetrahydrofuran + Butanedioic acid, dibutyl ester
- Water + Butanedioic acid, dibutyl ester
- Carbon dioxide + Butanedioic acid, dibutyl ester
Sources
- Crippen Method
- Crippen Method
- Solubilities and thermodynamic properties of SO2 in five biobased solvents
- Phase Behavior of Binary Mixtures Containing Succinic Acid or Its Esters
- Vapor Pressures and Enthalpies of Vaporization of a Series of the Symmetric Linear n-Alkyl Esters of Dicarboxylic Acids
- Solubilities of Carbon Dioxide in Five Bio-based Solvents
- Joback Method
- McGowan Method
- NIST Webbook
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