- InChI
- InChI=1S/C19H25F3O4/c1-4-7-8-9-25-17(23)19(5-2,6-3)18(24)26-12-13-10-15(21)16(22)11-14(13)20/h10-11H,4-9,12H2,1-3H3
- InChI Key
- PPJLQXNQRMCMIQ-UHFFFAOYSA-N
- Formula
- C19H25F3O4
- SMILES
-
CCCCCOC(=O)C(CC)(CC)C(=O)OCc1c
c(F)c(F)cc1F - Molecular Weight1
- 374.39
- 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° | -856.81 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1320.05 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 45.24 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 76.72 | kJ/mol | Joback Calculated Property |
| log10WS | -5.85 | Crippen Calculated Property | |
| logPoct/wat | 4.687 | Crippen Calculated Property | |
| McVol | 275.000 | ml/mol | McGowan Calculated Property |
| Pc | 1293.93 | kPa | Joback Calculated Property |
| Inp | 1995.00 | NIST | |
| Tboil | 822.90 | K | Joback Calculated Property |
| Tc | 1016.39 | K | Joback Calculated Property |
| Tfus | 516.38 | K | Joback Calculated Property |
| Vc | 1.083 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [841.26; 914.55] | J/mol×K | [822.90; 1016.39] | 
|
| Cp,gas | 841.26 | J/mol×K | 822.90 | Joback Calculated Property |
| Cp,gas | 855.87 | J/mol×K | 855.15 | Joback Calculated Property |
| Cp,gas | 869.48 | J/mol×K | 887.40 | Joback Calculated Property |
| Cp,gas | 882.13 | J/mol×K | 919.64 | Joback Calculated Property |
| Cp,gas | 893.85 | J/mol×K | 951.89 | Joback Calculated Property |
| Cp,gas | 904.64 | J/mol×K | 984.14 | Joback Calculated Property |
| Cp,gas | 914.55 | J/mol×K | 1016.39 | Joback Calculated Property |
Similar Compounds
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Sources
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