- InChI
- InChI=1S/C16H22F8O4/c1-4-10(9(2)3)28-12(26)7-5-6-11(25)27-8-14(19,20)16(23,24)15(21,22)13(17)18/h9-10,13H,4-8H2,1-3H3
- InChI Key
- VHYVUGVPDVZTEK-UHFFFAOYSA-N
- Formula
- C16H22F8O4
- SMILES
-
CCC(OC(=O)CCCC(=O)OCC(F)(F)C(F
)(F)C(F)(F)C(F)F)C(C)C - Molecular Weight1
- 430.33
- 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° | -1941.28 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2474.14 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 34.60 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 57.93 | kJ/mol | Joback Calculated Property |
| log10WS | -5.37 | Crippen Calculated Property | |
| logPoct/wat | 4.849 | Crippen Calculated Property | |
| McVol | 265.340 | ml/mol | McGowan Calculated Property |
| Pc | 1156.14 | kPa | Joback Calculated Property |
| Inp | [1623.00; 1623.00] |
|
|
| Inp | 1623.00 | NIST | |
| Inp | 1623.00 | NIST | |
| Tboil | 701.21 | K | Joback Calculated Property |
| Tc | 864.92 | K | Joback Calculated Property |
| Tfus | 381.38 | K | Joback Calculated Property |
| Vc | 1.073 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [803.90; 878.71] | J/mol×K | [701.21; 864.92] |
|
| Cp,gas | 803.90 | J/mol×K | 701.21 | Joback Calculated Property |
| Cp,gas | 818.34 | J/mol×K | 728.50 | Joback Calculated Property |
| Cp,gas | 831.95 | J/mol×K | 755.78 | Joback Calculated Property |
| Cp,gas | 844.75 | J/mol×K | 783.07 | Joback Calculated Property |
| Cp,gas | 856.78 | J/mol×K | 810.35 | Joback Calculated Property |
| Cp,gas | 868.09 | J/mol×K | 837.64 | Joback Calculated Property |
| Cp,gas | 878.71 | J/mol×K | 864.92 | Joback Calculated Property |
Similar Compounds
Sources
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