- InChI
- InChI=1S/C13H19F5O4/c1-4-7-21-9(19)11(5-2,6-3)10(20)22-8-12(14,15)13(16,17)18/h4-8H2,1-3H3
- InChI Key
- LSHAEGYZNQABIS-UHFFFAOYSA-N
- Formula
- C13H19F5O4
- SMILES
-
CCCOC(=O)C(CC)(CC)C(=O)OCC(F)(
F)C(F)(F)F - Molecular Weight1
- 334.28
- 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° | -1374.79 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1808.05 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 28.16 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 54.87 | kJ/mol | Joback Calculated Property |
| log10WS | -3.72 | Crippen Calculated Property | |
| logPoct/wat | 3.487 | Crippen Calculated Property | |
| McVol | 217.760 | ml/mol | McGowan Calculated Property |
| Pc | 1547.57 | kPa | Joback Calculated Property |
| Inp | 1192.00 | NIST | |
| Tboil | 636.08 | K | Joback Calculated Property |
| Tc | 804.10 | K | Joback Calculated Property |
| Tfus | 390.80 | K | Joback Calculated Property |
| Vc | 0.869 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [616.94; 688.75] | J/mol×K | [636.08; 804.10] | 
|
| Cp,gas | 616.94 | J/mol×K | 636.08 | Joback Calculated Property |
| Cp,gas | 630.77 | J/mol×K | 664.08 | Joback Calculated Property |
| Cp,gas | 643.81 | J/mol×K | 692.09 | Joback Calculated Property |
| Cp,gas | 656.09 | J/mol×K | 720.09 | Joback Calculated Property |
| Cp,gas | 667.66 | J/mol×K | 748.09 | Joback Calculated Property |
| Cp,gas | 678.53 | J/mol×K | 776.10 | Joback Calculated Property |
| Cp,gas | 688.75 | J/mol×K | 804.10 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, 2,2,3,3,3-pentafluoropropyl propyl ester.
Sources
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