- InChI
- InChI=1S/C7H9Cl2F3O2/c1-2-3-4-14-5(13)6(8,9)7(10,11)12/h2-4H2,1H3
- InChI Key
- UEOPJKJKJBWUIQ-UHFFFAOYSA-N
- Formula
- C7H9Cl2F3O2
- SMILES
- CCCCOC(=O)C(Cl)(Cl)C(F)(F)F
- Molecular Weight1
- 253.05
- CAS
- 309-23-9
- 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).
- 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° | -828.47 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1069.92 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 19.48 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 44.06 | kJ/mol | Joback Calculated Property |
| log10WS | -3.19 | Crippen Calculated Property | |
| logPoct/wat | 3.066 | Crippen Calculated Property | |
| McVol | 146.720 | ml/mol | McGowan Calculated Property |
| Pc | 2462.92 | kPa | Joback Calculated Property |
| Tboil | 502.06 | K | Joback Calculated Property |
| Tc | 684.78 | K | Joback Calculated Property |
| Tfus | 307.26 | K | Joback Calculated Property |
| Vc | 0.582 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [322.47; 375.97] | J/mol×K | [502.06; 684.78] | 
|
| Cp,gas | 322.47 | J/mol×K | 502.06 | Joback Calculated Property |
| Cp,gas | 332.96 | J/mol×K | 532.51 | Joback Calculated Property |
| Cp,gas | 342.78 | J/mol×K | 562.97 | Joback Calculated Property |
| Cp,gas | 351.96 | J/mol×K | 593.42 | Joback Calculated Property |
| Cp,gas | 360.53 | J/mol×K | 623.87 | Joback Calculated Property |
| Cp,gas | 368.52 | J/mol×K | 654.33 | Joback Calculated Property |
| Cp,gas | 375.97 | J/mol×K | 684.78 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propionic acid, 2,2-dichloro-3,3,3-trifluoro-, n-butyl ester.
Sources
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