- InChI
- InChI=1S/C12H14F8O4/c1-2-3-4-23-7(21)5-8(22)24-6-10(15,16)12(19,20)11(17,18)9(13)14/h9H,2-6H2,1H3
- InChI Key
- QOOYOAVOVBGFEB-UHFFFAOYSA-N
- Formula
- C12H14F8O4
- SMILES
-
CCCCOC(=O)CC(=O)OCC(F)(F)C(F)(
F)C(F)(F)C(F)F - Molecular Weight1
- 374.22
- 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 | 0.7519 | Relay (... Calculated Property | |
| ΔfG° | -1970.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2483.15 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 31.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.93 | kJ/mol | Relay (... Calculated Property |
| IE | 10.42 | eV | Relay (... Calculated Property |
| log10WS | -4.80 | Relay (... Calculated Property | |
| logPoct/wat | 3.434 | Crippen Calculated Property | |
| McVol | 208.980 | ml/mol | McGowan Calculated Property |
| Pc | 1510.50 | kPa | Joback Calculated Property |
| Inp | 1360.00 | NIST | |
| Tboil | 510.03 | K | Relay (... Calculated Property |
| Tc | 654.98 | K | Relay (... Calculated Property |
| Tfus | 236.45 | K | Relay (... Calculated Property |
| Vc | 0.796 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [590.05; 654.04] | J/mol×K | [610.57; 765.62] | 
|
| Cp,gas | 590.05 | J/mol×K | 610.57 | Joback Calculated Property |
| Cp,gas | 602.35 | J/mol×K | 636.41 | Joback Calculated Property |
| Cp,gas | 613.95 | J/mol×K | 662.25 | Joback Calculated Property |
| Cp,gas | 624.90 | J/mol×K | 688.09 | Joback Calculated Property |
| Cp,gas | 635.21 | J/mol×K | 713.94 | Joback Calculated Property |
| Cp,gas | 644.92 | J/mol×K | 739.78 | Joback Calculated Property |
| Cp,gas | 654.04 | J/mol×K | 765.62 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Malonic acid, butyl 2,2,3,3,4,4,5,5-octafluoropentyl ester.
Sources
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