- InChI
- InChI=1S/C16H22F8O4/c1-3-6-10(4-2)28-12(26)8-5-7-11(25)27-9-14(19,20)16(23,24)15(21,22)13(17)18/h10,13H,3-9H2,1-2H3
- InChI Key
- GTLQZPRDWKGRAU-UHFFFAOYSA-N
- Formula
- C16H22F8O4
- SMILES
-
CCCC(CC)OC(=O)CCCC(=O)OCC(F)(F
)C(F)(F)C(F)(F)C(F)F - Molecular Weight1
- 430.33
- 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 | 0.8596 | Relay (1.0) Calculated Property | |
| ΔfG° | -1938.84 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2565.52 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 38.12 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 83.34 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.97 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.48 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.993 | Crippen Calculated Property | |
| McVol | 265.340 | ml/mol | McGowan Calculated Property |
| Pc | 1149.87 | kPa | Joback Calculated Property |
| Inp | [1624.00; 1624.00] |
|
|
| Inp | 1624.00 | NIST | |
| Inp | 1624.00 | NIST | |
| Tboil | 556.16 | K | Relay (1.0) Calculated Property |
| Tc | 685.52 | K | Relay (1.0) Calculated Property |
| Tfus | 269.38 | K | Relay (1.0) Calculated Property |
| Vc | 1.001 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [803.42; 877.75] | J/mol×K | [701.65; 864.31] |
|
| Cp,gas | 803.42 | J/mol×K | 701.65 | Joback Calculated Property |
| Cp,gas | 817.74 | J/mol×K | 728.76 | Joback Calculated Property |
| Cp,gas | 831.24 | J/mol×K | 755.87 | Joback Calculated Property |
| Cp,gas | 843.95 | J/mol×K | 782.98 | Joback Calculated Property |
| Cp,gas | 855.92 | J/mol×K | 810.09 | Joback Calculated Property |
| Cp,gas | 867.17 | J/mol×K | 837.20 | Joback Calculated Property |
| Cp,gas | 877.75 | J/mol×K | 864.31 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl 3-hexyl ester.
Sources
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