- InChI
- InChI=1S/C14H24O4/c1-4-5-6-7-10-17-13(15)8-9-14(16)18-11-12(2)3/h5-6,12H,4,7-11H2,1-3H3/b6-5-
- InChI Key
- ZXVWBINETFYSQE-WAYWQWQTSA-N
- Formula
- C14H24O4
- SMILES
- CC/C=C\CCOC(=O)CCC(=O)OCC(C)C
- Molecular Weight1
- 256.34
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -873.36 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 34.27 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.82 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.18 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 2.865 | Crippen Calculated Property | |
| McVol | 218.700 | ml/mol | McGowan Calculated Property |
| Pc | 1721.73 | kPa | Joback Calculated Property |
| Inp | 1710.00 | NIST | |
| Tboil | 550.48 | K | Relay (1.0) Calculated Property |
| Tc | 716.61 | K | Relay (1.0) Calculated Property |
| Tfus | 213.24 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [600.60; 681.79] | J/mol×K | [676.02; 859.88] | 
|
| Cp,gas | 600.60 | J/mol×K | 676.02 | Joback Calculated Property |
| Cp,gas | 616.00 | J/mol×K | 706.66 | Joback Calculated Property |
| Cp,gas | 630.64 | J/mol×K | 737.31 | Joback Calculated Property |
| Cp,gas | 644.52 | J/mol×K | 767.95 | Joback Calculated Property |
| Cp,gas | 657.67 | J/mol×K | 798.59 | Joback Calculated Property |
| Cp,gas | 670.09 | J/mol×K | 829.24 | Joback Calculated Property |
| Cp,gas | 681.79 | J/mol×K | 859.88 | Joback Calculated Property |
| η | [0.0000955; 0.0017024] | Pa×s | [371.78; 676.02] |
|
| η | 0.0017024 | Pa×s | 371.78 | Joback Calculated Property |
| η | 0.0007897 | Pa×s | 422.49 | Joback Calculated Property |
| η | 0.0004319 | Pa×s | 473.19 | Joback Calculated Property |
| η | 0.0002655 | Pa×s | 523.90 | Joback Calculated Property |
| η | 0.0001778 | Pa×s | 574.61 | Joback Calculated Property |
| η | 0.0001271 | Pa×s | 625.31 | Joback Calculated Property |
| η | 0.0000955 | Pa×s | 676.02 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, cis-hex-3-enyl isobutyl ester.
Sources
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