- InChI
- InChI=1S/C15H27FO4/c1-4-7-8-9-11-19-13(17)15(5-2,6-3)14(18)20-12-10-16/h4-12H2,1-3H3
- InChI Key
- OUYNJXBBQIRUOF-UHFFFAOYSA-N
- Formula
- C15H27FO4
- SMILES
- CCCCCCOC(=O)C(CC)(CC)C(=O)OCCF
- Molecular Weight1
- 290.37
- ω : Acentric Factor.
- 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).
- 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 | 0.7939 | Relay (1.0) Calculated Property | |
| ΔfG° | -584.39 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1137.50 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 35.85 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.29 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.79 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.63 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.429 | Crippen Calculated Property | |
| McVol | 238.860 | ml/mol | McGowan Calculated Property |
| Pc | 1488.44 | kPa | Joback Calculated Property |
| Inp | [1662.00; 1662.00] |
|
|
| Inp | 1662.00 | NIST | |
| Inp | 1662.00 | NIST | |
| Tboil | 557.28 | K | Relay (1.0) Calculated Property |
| Tc | 745.70 | K | Relay (1.0) Calculated Property |
| Tfus | 259.75 | K | Relay (1.0) Calculated Property |
| Vc | 0.867 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [687.48; 771.28] | J/mol×K | [691.22; 867.88] |
|
| Cp,gas | 687.48 | J/mol×K | 691.22 | Joback Calculated Property |
| Cp,gas | 703.41 | J/mol×K | 720.66 | Joback Calculated Property |
| Cp,gas | 718.54 | J/mol×K | 750.11 | Joback Calculated Property |
| Cp,gas | 732.87 | J/mol×K | 779.55 | Joback Calculated Property |
| Cp,gas | 746.42 | J/mol×K | 809.00 | Joback Calculated Property |
| Cp,gas | 759.22 | J/mol×K | 838.44 | Joback Calculated Property |
| Cp,gas | 771.28 | J/mol×K | 867.88 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, 2-fluoroethyl hexyl ester.
Sources
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