- InChI
- InChI=1S/C14H16F2O4/c1-2-19-13(17)4-3-5-14(18)20-9-10-8-11(15)6-7-12(10)16/h6-8H,2-5,9H2,1H3
- InChI Key
- LYWBOJQKGWQXTF-UHFFFAOYSA-N
- Formula
- C14H16F2O4
- SMILES
- CCOC(=O)CCCC(=O)OCc1cc(F)ccc1F
- Molecular Weight1
- 286.27
- 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° | -697.31 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1000.52 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.01 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.04 | kJ/mol | Joback Calculated Property |
| log10WS | -3.67 | Crippen Calculated Property | |
| logPoct/wat | 2.741 | Crippen Calculated Property | |
| McVol | 202.780 | ml/mol | McGowan Calculated Property |
| Pc | 1959.60 | kPa | Joback Calculated Property |
| Inp | [1843.00; 1843.00] |
|
|
| Inp | 1843.00 | NIST | |
| Inp | 1843.00 | NIST | |
| Tboil | 707.48 | K | Joback Calculated Property |
| Tc | 899.73 | K | Joback Calculated Property |
| Tfus | 444.50 | K | Joback Calculated Property |
| Vc | 0.795 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [554.85; 622.01] | J/mol×K | [707.48; 899.73] |
|
| Cp,gas | 554.85 | J/mol×K | 707.48 | Joback Calculated Property |
| Cp,gas | 567.96 | J/mol×K | 739.52 | Joback Calculated Property |
| Cp,gas | 580.30 | J/mol×K | 771.56 | Joback Calculated Property |
| Cp,gas | 591.88 | J/mol×K | 803.61 | Joback Calculated Property |
| Cp,gas | 602.68 | J/mol×K | 835.65 | Joback Calculated Property |
| Cp,gas | 612.73 | J/mol×K | 867.69 | Joback Calculated Property |
| Cp,gas | 622.01 | J/mol×K | 899.73 | Joback Calculated Property |
Similar Compounds
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Sources
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