- InChI
- InChI=1S/C5H7F3O2/c1-2-3-10-4(9)5(6,7)8/h2-3H2,1H3
- InChI Key
- CDXJNCAVPFGVNL-UHFFFAOYSA-N
- Formula
- C5H7F3O2
- SMILES
- CCCOC(=O)C(F)(F)F
- Molecular Weight1
- 156.10
- CAS
- 383-66-4
- Other Names
-
- Acetic acid, trifluoro-, propyl ester
- Propyl trifluoroacetate
- CF3CO2(n-C3H7)
- PAff : Proton affinity (kJ/mol).
- BasG : Gas basicity (kJ/mol).
- 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 |
|---|---|---|---|
| PAff | 763.90 | kJ/mol | NIST |
| BasG | 732.90 | kJ/mol | NIST |
| ΔfG° | -824.29 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -988.41 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 13.32 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 32.13 | kJ/mol | Joback Calculated Property |
| log10WS | -1.44 | Crippen Calculated Property | |
| logPoct/wat | 1.502 | Crippen Calculated Property | |
| McVol | 94.060 | ml/mol | McGowan Calculated Property |
| Pc | 3199.16 | kPa | Joback Calculated Property |
| Inp | [558.60; 569.60] |
|
|
| Inp | 559.00 | NIST | |
| Inp | 558.60 | NIST | |
| Inp | 569.60 | NIST | |
| Tboil | 384.67 | K | Joback Calculated Property |
| Tc | 546.37 | K | Joback Calculated Property |
| Tfus | 222.46 | K | Joback Calculated Property |
| Vc | 0.383 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [190.04; 235.45] | J/mol×K | [384.67; 546.37] |
|
| Cp,gas | 190.04 | J/mol×K | 384.67 | Joback Calculated Property |
| Cp,gas | 198.49 | J/mol×K | 411.62 | Joback Calculated Property |
| Cp,gas | 206.57 | J/mol×K | 438.57 | Joback Calculated Property |
| Cp,gas | 214.30 | J/mol×K | 465.52 | Joback Calculated Property |
| Cp,gas | 221.68 | J/mol×K | 492.47 | Joback Calculated Property |
| Cp,gas | 228.73 | J/mol×K | 519.42 | Joback Calculated Property |
| Cp,gas | 235.45 | J/mol×K | 546.37 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to CF3C(O)O(CH2)2CH3.
Sources
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