- InChI
- InChI=1S/C24H20F10O4/c25-15-11(16(26)20(30)23(33)19(15)29)9-37-13(35)7-5-3-1-2-4-6-8-14(36)38-10-12-17(27)21(31)24(34)22(32)18(12)28/h1-10H2
- InChI Key
- PSADLRIMTFQPKD-UHFFFAOYSA-N
- Formula
- C24H20F10O4
- SMILES
-
O=C(CCCCCCCCC(=O)OCc1c(F)c(F)c
(F)c(F)c1F)OCc1c(F)c(F)c(F)c(F )c1F - Molecular Weight1
- 562.40
- 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° | -2136.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2631.03 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 78.48 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 90.33 | kJ/mol | Joback Calculated Property |
| log10WS | -10.11 | Crippen Calculated Property | |
| logPoct/wat | 6.985 | Crippen Calculated Property | |
| McVol | 334.080 | ml/mol | McGowan Calculated Property |
| Pc | 881.57 | kPa | Joback Calculated Property |
| Inp | 2731.00 | NIST | |
| Tboil | 996.96 | K | Joback Calculated Property |
| Tc | 1235.29 | K | Joback Calculated Property |
| Tfus | 688.50 | K | Joback Calculated Property |
| Vc | 1.391 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1074.81; 1120.85] | J/mol×K | [996.96; 1235.29] | 
|
| Cp,gas | 1074.81 | J/mol×K | 996.96 | Joback Calculated Property |
| Cp,gas | 1086.92 | J/mol×K | 1036.68 | Joback Calculated Property |
| Cp,gas | 1097.26 | J/mol×K | 1076.40 | Joback Calculated Property |
| Cp,gas | 1105.82 | J/mol×K | 1116.13 | Joback Calculated Property |
| Cp,gas | 1112.60 | J/mol×K | 1155.85 | Joback Calculated Property |
| Cp,gas | 1117.61 | J/mol×K | 1195.57 | Joback Calculated Property |
| Cp,gas | 1120.85 | J/mol×K | 1235.29 | Joback Calculated Property |
Similar Compounds
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Sources
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