- InChI
- InChI=1S/C20H35F3O4/c1-5-8-9-10-11-12-13-14-15-26-17(24)19(6-2,7-3)18(25)27-16(4)20(21,22)23/h16H,5-15H2,1-4H3
- InChI Key
- JAMOXBZTNAPWNM-UHFFFAOYSA-N
- Formula
- C20H35F3O4
- SMILES
-
CCCCCCCCCCOC(=O)C(CC)(CC)C(=O)
OC(C)C(F)(F)F - Molecular Weight1
- 396.48
- 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° | -931.51 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1556.84 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 44.02 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 72.99 | kJ/mol | Joback Calculated Property |
| log10WS | -6.45 | Crippen Calculated Property | |
| logPoct/wat | 5.971 | Crippen Calculated Property | |
| McVol | 312.850 | ml/mol | McGowan Calculated Property |
| Pc | 1017.48 | kPa | Joback Calculated Property |
| Inp | 1893.00 | NIST | |
| Tboil | 800.49 | K | Joback Calculated Property |
| Tc | 982.51 | K | Joback Calculated Property |
| Tfus | 451.09 | K | Joback Calculated Property |
| Vc | 1.230 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [994.07; 1083.91] | J/mol×K | [800.49; 982.51] | 
|
| Cp,gas | 994.07 | J/mol×K | 800.49 | Joback Calculated Property |
| Cp,gas | 1011.45 | J/mol×K | 830.83 | Joback Calculated Property |
| Cp,gas | 1027.81 | J/mol×K | 861.16 | Joback Calculated Property |
| Cp,gas | 1043.20 | J/mol×K | 891.50 | Joback Calculated Property |
| Cp,gas | 1057.65 | J/mol×K | 921.84 | Joback Calculated Property |
| Cp,gas | 1071.20 | J/mol×K | 952.18 | Joback Calculated Property |
| Cp,gas | 1083.91 | J/mol×K | 982.51 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, decyl 1,1,1-trifluoroprop-2-yl ester.
Sources
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