- InChI
- InChI=1S/C23H41F5O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-30-21(29)22(24,25)23(26,27)28/h2-20H2,1H3
- InChI Key
- JGDSVZMRPCCVOK-UHFFFAOYSA-N
- Formula
- C23H41F5O2
- SMILES
-
CCCCCCCCCCCCCCCCCCCCOC(=O)C(F)
(F)C(F)(F)F - Molecular Weight1
- 444.56
- Other Names
-
- Eicosyl 2,2,3,3,3-pentafluoropropanoate
- 1-Eicosanol, pentafluoropropionate
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -1059.51 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1760.90 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 58.68 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.27 | kJ/mol | Joback Calculated Property |
| log10WS | -9.29 | Crippen Calculated Property | |
| logPoct/wat | 8.769 | Crippen Calculated Property | |
| McVol | 351.220 | ml/mol | McGowan Calculated Property |
| Pc | 785.95 | kPa | Joback Calculated Property |
| Inp | 2198.50 | NIST | |
| Tboil | 791.82 | K | Joback Calculated Property |
| Tc | 969.66 | K | Joback Calculated Property |
| Tfus | 428.92 | K | Joback Calculated Property |
| Vc | 1.415 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1132.07; 1236.99] | J/mol×K | [791.82; 969.66] | 
|
| Cp,gas | 1132.07 | J/mol×K | 791.82 | Joback Calculated Property |
| Cp,gas | 1152.04 | J/mol×K | 821.46 | Joback Calculated Property |
| Cp,gas | 1170.94 | J/mol×K | 851.10 | Joback Calculated Property |
| Cp,gas | 1188.83 | J/mol×K | 880.74 | Joback Calculated Property |
| Cp,gas | 1205.76 | J/mol×K | 910.38 | Joback Calculated Property |
| Cp,gas | 1221.79 | J/mol×K | 940.02 | Joback Calculated Property |
| Cp,gas | 1236.99 | J/mol×K | 969.66 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Eicosyl pentafluoropropionate.
Sources
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