- InChI
- InChI=1S/C8H14O4/c1-3-5(7(9)10)6(4-2)8(11)12/h5-6H,3-4H2,1-2H3,(H,9,10)(H,11,12)/t5-,6+
- InChI Key
- KJXMXCRSMLOXBM-OLQVQODUSA-N
- Formula
- C8H14O4
- SMILES
-
CC[C@H](C(=O)O)[C@@H](CC)C(=O)
O - Molecular Weight1
- 174.20
- 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).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (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).
- Pc : Critical Pressure (kPa).
- 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 |
|---|---|---|---|
| ω | 0.7718 | Relay (1.0) Calculated Property | |
| ΔcH°solid | -4130.00 | kJ/mol | NIST |
| ΔfG° | -676.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -879.22 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 29.72 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 92.95 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.94 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.14 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.208 | Crippen Calculated Property | |
| McVol | 138.460 | ml/mol | McGowan Calculated Property |
| Pc | 3114.04 | kPa | Joback Calculated Property |
| Tboil | 516.45 | K | Relay (1.0) Calculated Property |
| Tc | 755.52 | K | Relay (1.0) Calculated Property |
| Tfus | 414.44 | K | Relay (1.0) Calculated Property |
| Vc | 0.511 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [379.14; 431.82] | J/mol×K | [672.78; 878.35] | 
|
| Cp,gas | 379.14 | J/mol×K | 672.78 | Joback Calculated Property |
| Cp,gas | 389.38 | J/mol×K | 707.04 | Joback Calculated Property |
| Cp,gas | 398.99 | J/mol×K | 741.30 | Joback Calculated Property |
| Cp,gas | 408.01 | J/mol×K | 775.57 | Joback Calculated Property |
| Cp,gas | 416.46 | J/mol×K | 809.83 | Joback Calculated Property |
| Cp,gas | 424.39 | J/mol×K | 844.09 | Joback Calculated Property |
| Cp,gas | 431.82 | J/mol×K | 878.35 | Joback Calculated Property |
| η | [0.0001699; 0.0009330] | Pa×s | [471.12; 672.78] |
|
| η | 0.0009330 | Pa×s | 471.12 | Joback Calculated Property |
| η | 0.0006391 | Pa×s | 504.73 | Joback Calculated Property |
| η | 0.0004589 | Pa×s | 538.34 | Joback Calculated Property |
| η | 0.0003426 | Pa×s | 571.95 | Joback Calculated Property |
| η | 0.0002642 | Pa×s | 605.56 | Joback Calculated Property |
| η | 0.0002094 | Pa×s | 639.17 | Joback Calculated Property |
| η | 0.0001699 | Pa×s | 672.78 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Meso-2,3-diethylbutanedioic acid.
Sources
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