- InChI
- InChI=1S/C5H5F3O2/c1-2-4(9)10-3-5(6,7)8/h2H,1,3H2
- InChI Key
- VBHXIMACZBQHPX-UHFFFAOYSA-N
- Formula
- C5H5F3O2
- SMILES
- C=CC(=O)OCC(F)(F)F
- Molecular Weight1
- 154.09
- CAS
- 407-47-6
- Other Names
-
- 2-Propenoic acid, 2,2,2-trifluoroethyl ester
- Acrylic acid, 2,2,2-trifluoroethyl ester
- 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).
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (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 | 0.4159 | Relay (1.0) Calculated Property | |
| ΔfG° | -736.45 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -970.46 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 12.04 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 38.66 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 11.25 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.90 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.278 | Crippen Calculated Property | |
| McVol | 89.760 | ml/mol | McGowan Calculated Property |
| Pc | 3356.75 | kPa | Joback Calculated Property |
| Tboil | 366.51 | K | Relay (1.0) Calculated Property |
| Tc | 529.73 | K | Relay (1.0) Calculated Property |
| Tfus | 231.33 | K | Relay (1.0) Calculated Property |
| Vc | 0.321 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [175.99; 217.50] | J/mol×K | [381.35; 546.30] | 
|
| Cp,gas | 175.99 | J/mol×K | 381.35 | Joback Calculated Property |
| Cp,gas | 183.82 | J/mol×K | 408.84 | Joback Calculated Property |
| Cp,gas | 191.27 | J/mol×K | 436.33 | Joback Calculated Property |
| Cp,gas | 198.35 | J/mol×K | 463.83 | Joback Calculated Property |
| Cp,gas | 205.08 | J/mol×K | 491.32 | Joback Calculated Property |
| Cp,gas | 211.46 | J/mol×K | 518.81 | Joback Calculated Property |
| Cp,gas | 217.50 | J/mol×K | 546.30 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | [319.00; 319.20] | K | [16.70; 16.70] |
|
| Tboilr | 319.20 | K | 16.70 | NIST |
| Tboilr | 319.00 | K | 16.70 | NIST |
Similar Compounds
Find more compounds similar to 2,2,2-Trifluoroethyl acrylate.
Sources
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