- InChI
- InChI=1S/C12H19F3O4/c1-4-9(5-2)19-11(17)7-6-10(16)18-8(3)12(13,14)15/h8-9H,4-7H2,1-3H3
- InChI Key
- AGZAFEUKLZXKMX-UHFFFAOYSA-N
- Formula
- C12H19F3O4
- SMILES
-
CCC(CC)OC(=O)CCC(=O)OC(C)C(F)(
F)F - Molecular Weight1
- 284.27
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.6746 | Relay (1.0) Calculated Property | |
| ΔfG° | -1004.15 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1576.37 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 27.19 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.75 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.33 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.76 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.992 | Crippen Calculated Property | |
| McVol | 200.130 | ml/mol | McGowan Calculated Property |
| Pc | 1768.38 | kPa | Joback Calculated Property |
| Inp | 1293.00 | NIST | |
| Tboil | 492.01 | K | Relay (1.0) Calculated Property |
| Tc | 633.52 | K | Relay (1.0) Calculated Property |
| Tfus | 249.83 | K | Relay (1.0) Calculated Property |
| Vc | 0.739 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [543.97; 617.49] | J/mol×K | [620.24; 791.52] | 
|
| Cp,gas | 543.97 | J/mol×K | 620.24 | Joback Calculated Property |
| Cp,gas | 557.89 | J/mol×K | 648.79 | Joback Calculated Property |
| Cp,gas | 571.12 | J/mol×K | 677.33 | Joback Calculated Property |
| Cp,gas | 583.69 | J/mol×K | 705.88 | Joback Calculated Property |
| Cp,gas | 595.59 | J/mol×K | 734.42 | Joback Calculated Property |
| Cp,gas | 606.86 | J/mol×K | 762.97 | Joback Calculated Property |
| Cp,gas | 617.49 | J/mol×K | 791.52 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 1,1,1-trifluoro-2-propyl 3-pentyl ester.
Sources
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