- InChI
- InChI=1S/C14H24O4/c1-11(2)8-9-17-13(15)6-5-7-14(16)18-10-12(3)4/h12H,1,5-10H2,2-4H3
- InChI Key
- HCEPQGMYGLGTFS-UHFFFAOYSA-N
- Formula
- C14H24O4
- SMILES
- C=C(C)CCOC(=O)CCCC(=O)OCC(C)C
- Molecular Weight1
- 256.34
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- 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).
- Inp : Non-polar retention indices.
- 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° | -323.99 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -711.53 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 31.48 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.09 | kJ/mol | Joback Calculated Property |
| log10WS | -3.02 | Crippen Calculated Property | |
| logPoct/wat | 2.865 | Crippen Calculated Property | |
| McVol | 218.700 | ml/mol | McGowan Calculated Property |
| Pc | 1714.61 | kPa | Joback Calculated Property |
| Inp | [1733.00; 1733.00] |
|
|
| Inp | 1733.00 | NIST | |
| Inp | 1733.00 | NIST | |
| Tboil | 668.42 | K | Joback Calculated Property |
| Tc | 851.28 | K | Joback Calculated Property |
| Tfus | 361.14 | K | Joback Calculated Property |
| Vc | 0.844 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [599.12; 681.01] | J/mol×K | [668.42; 851.28] |
|
| Cp,gas | 599.12 | J/mol×K | 668.42 | Joback Calculated Property |
| Cp,gas | 614.64 | J/mol×K | 698.90 | Joback Calculated Property |
| Cp,gas | 629.40 | J/mol×K | 729.37 | Joback Calculated Property |
| Cp,gas | 643.42 | J/mol×K | 759.85 | Joback Calculated Property |
| Cp,gas | 656.68 | J/mol×K | 790.33 | Joback Calculated Property |
| Cp,gas | 669.21 | J/mol×K | 820.80 | Joback Calculated Property |
| Cp,gas | 681.01 | J/mol×K | 851.28 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, isobutyl 3-methylbut-3-enyl ester.
Sources
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