- InChI
- InChI=1S/C24H26F4O4/c25-19-9-11-21(27)17(13-19)15-31-23(29)7-5-3-1-2-4-6-8-24(30)32-16-18-14-20(26)10-12-22(18)28/h9-14H,1-8,15-16H2
- InChI Key
- IKZQWNAAUFTQOB-UHFFFAOYSA-N
- Formula
- C24H26F4O4
- SMILES
-
O=C(CCCCCCCCC(=O)OCc1cc(F)ccc1
F)OCc1cc(F)ccc1F - Molecular Weight1
- 454.45
- 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° | -909.58 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1385.55 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 62.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.26 | kJ/mol | Joback Calculated Property |
| log10WS | -8.12 | Crippen Calculated Property | |
| logPoct/wat | 6.150 | Crippen Calculated Property | |
| McVol | 323.460 | ml/mol | McGowan Calculated Property |
| Pc | 1105.21 | kPa | Joback Calculated Property |
| Inp | [2903.00; 2903.00] |
|
|
| Inp | 2903.00 | NIST | |
| Inp | 2903.00 | NIST | |
| Tboil | 971.46 | K | Joback Calculated Property |
| Tc | 1189.37 | K | Joback Calculated Property |
| Tfus | 609.84 | K | Joback Calculated Property |
| Vc | 1.284 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1041.21; 1100.02] | J/mol×K | [971.46; 1189.37] |
|
| Cp,gas | 1041.21 | J/mol×K | 971.46 | Joback Calculated Property |
| Cp,gas | 1054.31 | J/mol×K | 1007.78 | Joback Calculated Property |
| Cp,gas | 1066.05 | J/mol×K | 1044.10 | Joback Calculated Property |
| Cp,gas | 1076.45 | J/mol×K | 1080.41 | Joback Calculated Property |
| Cp,gas | 1085.56 | J/mol×K | 1116.73 | Joback Calculated Property |
| Cp,gas | 1093.40 | J/mol×K | 1153.05 | Joback Calculated Property |
| Cp,gas | 1100.02 | J/mol×K | 1189.37 | Joback Calculated Property |
Similar Compounds
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Sources
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