- InChI
- InChI=1S/C24H43F5O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-31-22(30)23(25,26)24(27,28)29/h2-21H2,1H3
- InChI Key
- YUWKLSZGOWPPPE-UHFFFAOYSA-N
- Formula
- C24H43F5O2
- SMILES
-
CCCCCCCCCCCCCCCCCCCCCOC(=O)C(F
)(F)C(F)(F)F - Molecular Weight1
- 458.59
- Other Names
-
- Heneicosyl 2,2,3,3,3-pentafluoropropanoate
- 1-Heneicosanol, 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° | -1051.09 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1781.54 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 61.27 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.50 | kJ/mol | Joback Calculated Property |
| log10WS | -9.71 | Crippen Calculated Property | |
| logPoct/wat | 9.159 | Crippen Calculated Property | |
| McVol | 365.310 | ml/mol | McGowan Calculated Property |
| Pc | 745.29 | kPa | Joback Calculated Property |
| Inp | [2294.60; 2294.60] |
|
|
| Inp | 2294.60 | NIST | |
| Inp | 2294.60 | NIST | |
| Tboil | 814.70 | K | Joback Calculated Property |
| Tc | 998.78 | K | Joback Calculated Property |
| Tfus | 440.19 | K | Joback Calculated Property |
| Vc | 1.472 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1194.40; 1302.71] | J/mol×K | [814.70; 998.78] |
|
| Cp,gas | 1194.40 | J/mol×K | 814.70 | Joback Calculated Property |
| Cp,gas | 1215.09 | J/mol×K | 845.38 | Joback Calculated Property |
| Cp,gas | 1234.64 | J/mol×K | 876.06 | Joback Calculated Property |
| Cp,gas | 1253.11 | J/mol×K | 906.74 | Joback Calculated Property |
| Cp,gas | 1270.57 | J/mol×K | 937.42 | Joback Calculated Property |
| Cp,gas | 1287.08 | J/mol×K | 968.10 | Joback Calculated Property |
| Cp,gas | 1302.71 | J/mol×K | 998.78 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Heneicosyl pentafluoropropionate.
Sources
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