- InChI
- InChI=1S/C24H16F6O4/c25-23(26,27)19-11-5-1-7-15(19)13-33-21(31)17-9-3-4-10-18(17)22(32)34-14-16-8-2-6-12-20(16)24(28,29)30/h1-12H,13-14H2
- InChI Key
- HQZDVFVHGMRAOZ-UHFFFAOYSA-N
- Formula
- C24H16F6O4
- SMILES
-
O=C(OCc1ccccc1C(F)(F)F)c1ccccc
1C(=O)OCc1ccccc1C(F)(F)F - Molecular Weight1
- 482.37
- 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° | -1171.48 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1547.27 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 48.10 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 88.65 | kJ/mol | Joback Calculated Property |
| log10WS | -8.38 | Crippen Calculated Property | |
| logPoct/wat | 6.438 | Crippen Calculated Property | |
| McVol | 303.240 | ml/mol | McGowan Calculated Property |
| Pc | 1357.63 | kPa | Joback Calculated Property |
| Inp | [2675.00; 2675.00] |
|
|
| Inp | 2675.00 | NIST | |
| Inp | 2675.00 | NIST | |
| Tboil | 985.24 | K | Joback Calculated Property |
| Tc | 1213.68 | K | Joback Calculated Property |
| Tfus | 629.76 | K | Joback Calculated Property |
| Vc | 1.190 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [949.10; 997.33] | J/mol×K | [985.24; 1213.68] |
|
| Cp,gas | 949.10 | J/mol×K | 985.24 | Joback Calculated Property |
| Cp,gas | 959.37 | J/mol×K | 1023.31 | Joback Calculated Property |
| Cp,gas | 968.59 | J/mol×K | 1061.39 | Joback Calculated Property |
| Cp,gas | 976.90 | J/mol×K | 1099.46 | Joback Calculated Property |
| Cp,gas | 984.38 | J/mol×K | 1137.53 | Joback Calculated Property |
| Cp,gas | 991.16 | J/mol×K | 1175.61 | Joback Calculated Property |
| Cp,gas | 997.33 | J/mol×K | 1213.68 | Joback Calculated Property |
Similar Compounds
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Sources
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