- InChI
- InChI=1S/C8H4F12O2/c1-22-3(21)5(13,14)7(17,18)8(19,20)6(15,16)4(11,12)2(9)10/h2H,1H3
- InChI Key
- OJPGHRSOBKDLSK-UHFFFAOYSA-N
- Formula
- C8H4F12O2
- SMILES
-
COC(=O)C(F)(F)C(F)(F)C(F)(F)C(
F)(F)C(F)(F)C(F)F - Molecular Weight1
- 360.10
- 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).
- 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 |
|---|---|---|---|
| ω | 0.5250 | Relay (1.0) Calculated Property | |
| ΔfG° | -2543.40 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2861.09 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 15.63 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.06 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 11.02 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.31 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.601 | Crippen Calculated Property | |
| McVol | 152.260 | ml/mol | McGowan Calculated Property |
| Pc | 1769.87 | kPa | Joback Calculated Property |
| Inp | 614.00 | NIST | |
| Tboil | 424.03 | K | Relay (1.0) Calculated Property |
| Tc | 577.72 | K | Relay (1.0) Calculated Property |
| Tfus | 279.25 | K | Relay (1.0) Calculated Property |
| Vc | 0.626 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [390.06; 449.69] | J/mol×K | [433.38; 567.49] | 
|
| Cp,gas | 390.06 | J/mol×K | 433.38 | Joback Calculated Property |
| Cp,gas | 401.73 | J/mol×K | 455.73 | Joback Calculated Property |
| Cp,gas | 412.66 | J/mol×K | 478.08 | Joback Calculated Property |
| Cp,gas | 422.89 | J/mol×K | 500.44 | Joback Calculated Property |
| Cp,gas | 432.46 | J/mol×K | 522.79 | Joback Calculated Property |
| Cp,gas | 441.38 | J/mol×K | 545.14 | Joback Calculated Property |
| Cp,gas | 449.69 | J/mol×K | 567.49 | Joback Calculated Property |
Similar Compounds
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Sources
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