- InChI
- InChI=1S/C15H28O4/c1-3-5-6-10-13-19-15(17)12-9-7-8-11-14(16)18-4-2/h3-13H2,1-2H3
- InChI Key
- UNVQGXRYENKZPR-UHFFFAOYSA-N
- Formula
- C15H28O4
- SMILES
- CCCCCCOC(=O)CCCCCC(=O)OCC
- Molecular Weight1
- 272.38
- ω : Acentric Factor.
- 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).
- 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 |
|---|---|---|---|
| ω | 0.8604 | Relay (1.0) Calculated Property | |
| ΔfG° | -545.32 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -976.75 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 43.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.75 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.45 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.73 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.623 | Crippen Calculated Property | |
| McVol | 237.090 | ml/mol | McGowan Calculated Property |
| Pc | 1426.15 | kPa | Joback Calculated Property |
| Inp | [1502.00; 1502.00] |
|
|
| Inp | 1502.00 | NIST | |
| Inp | 1502.00 | NIST | |
| Tboil | 570.18 | K | Relay (1.0) Calculated Property |
| Tc | 740.84 | K | Relay (1.0) Calculated Property |
| Tfus | 255.41 | K | Relay (1.0) Calculated Property |
| Vc | 0.928 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [662.92; 750.00] | J/mol×K | [659.24; 830.02] |
|
| Cp,gas | 662.92 | J/mol×K | 659.24 | Joback Calculated Property |
| Cp,gas | 679.41 | J/mol×K | 687.70 | Joback Calculated Property |
| Cp,gas | 695.10 | J/mol×K | 716.17 | Joback Calculated Property |
| Cp,gas | 709.99 | J/mol×K | 744.63 | Joback Calculated Property |
| Cp,gas | 724.10 | J/mol×K | 773.09 | Joback Calculated Property |
| Cp,gas | 737.44 | J/mol×K | 801.56 | Joback Calculated Property |
| Cp,gas | 750.00 | J/mol×K | 830.02 | Joback Calculated Property |
| η | [0.0000863; 0.0028271] | Pa×s | [343.47; 659.24] |
|
| η | 0.0028271 | Pa×s | 343.47 | Joback Calculated Property |
| η | 0.0010739 | Pa×s | 396.10 | Joback Calculated Property |
| η | 0.0005119 | Pa×s | 448.73 | Joback Calculated Property |
| η | 0.0002851 | Pa×s | 501.36 | Joback Calculated Property |
| η | 0.0001774 | Pa×s | 553.98 | Joback Calculated Property |
| η | 0.0001199 | Pa×s | 606.61 | Joback Calculated Property |
| η | 0.0000863 | Pa×s | 659.24 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Pimelic acid, ethyl hexyl ester.
Sources
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