- InChI
- InChI=1S/C9H8F6O4/c1-5(7(17)19-4-9(13,14)15)2-6(16)18-3-8(10,11)12/h1-4H2
- InChI Key
- IRXUFAGEXMCXHZ-UHFFFAOYSA-N
- Formula
- C9H8F6O4
- SMILES
-
C=C(CC(=O)OCC(F)(F)F)C(=O)OCC(
F)(F)F - Molecular Weight1
- 294.15
- CAS
- 104534-96-5
- 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° | -1526.83 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1797.21 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 25.70 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 45.86 | kJ/mol | Joback Calculated Property |
| log10WS | -2.49 | Crippen Calculated Property | |
| logPoct/wat | 2.144 | Crippen Calculated Property | |
| McVol | 158.870 | ml/mol | McGowan Calculated Property |
| Pc | 2113.89 | kPa | Joback Calculated Property |
| Tboil | 543.62 | K | Joback Calculated Property |
| Tc | 704.76 | K | Joback Calculated Property |
| Tfus | 328.17 | K | Joback Calculated Property |
| Vc | 0.655 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [404.80; 458.22] | J/mol×K | [543.62; 704.76] | 
|
| Cp,gas | 404.80 | J/mol×K | 543.62 | Joback Calculated Property |
| Cp,gas | 415.05 | J/mol×K | 570.48 | Joback Calculated Property |
| Cp,gas | 424.74 | J/mol×K | 597.33 | Joback Calculated Property |
| Cp,gas | 433.88 | J/mol×K | 624.19 | Joback Calculated Property |
| Cp,gas | 442.49 | J/mol×K | 651.05 | Joback Calculated Property |
| Cp,gas | 450.60 | J/mol×K | 677.91 | Joback Calculated Property |
| Cp,gas | 458.22 | J/mol×K | 704.76 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Bis(2,2,2-trifluoroethyl) itaconate.
Sources
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