- InChI
- InChI=1S/C13H11F5O4/c1-2-21-6(19)4-3-5-7(20)22-13-11(17)9(15)8(14)10(16)12(13)18/h2-5H2,1H3
- InChI Key
- ZDRSJTSCTLYWMD-UHFFFAOYSA-N
- Formula
- C13H11F5O4
- SMILES
-
CCOC(=O)CCCC(=O)Oc1c(F)c(F)c(F
)c(F)c1F - Molecular Weight1
- 326.22
- 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 | 0.7879 | Relay (1.0) Calculated Property | |
| ΔfG° | -1471.95 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1485.22 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 45.66 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.61 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.27 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.89 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.021 | Crippen Calculated Property | |
| McVol | 194.000 | ml/mol | McGowan Calculated Property |
| Pc | 1700.50 | kPa | Joback Calculated Property |
| Inp | 1602.00 | NIST | |
| Tboil | 528.50 | K | Relay (1.0) Calculated Property |
| Tc | 723.37 | K | Relay (1.0) Calculated Property |
| Tfus | 290.89 | K | Relay (1.0) Calculated Property |
| Vc | 0.738 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [515.74; 573.58] | J/mol×K | [661.41; 834.39] | 
|
| Cp,gas | 515.74 | J/mol×K | 661.41 | Joback Calculated Property |
| Cp,gas | 526.89 | J/mol×K | 690.24 | Joback Calculated Property |
| Cp,gas | 537.44 | J/mol×K | 719.07 | Joback Calculated Property |
| Cp,gas | 547.39 | J/mol×K | 747.90 | Joback Calculated Property |
| Cp,gas | 556.74 | J/mol×K | 776.73 | Joback Calculated Property |
| Cp,gas | 565.47 | J/mol×K | 805.56 | Joback Calculated Property |
| Cp,gas | 573.58 | J/mol×K | 834.39 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, ethyl pentafluorophenyl ester.
Sources
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