- InChI
- InChI=1S/C17H27F5O4/c1-6-9-12(11(4)5)26-14(24)15(7-2,8-3)13(23)25-10-16(18,19)17(20,21)22/h11-12H,6-10H2,1-5H3
- InChI Key
- XBLUODVGWMIYKE-UHFFFAOYSA-N
- Formula
- C17H27F5O4
- SMILES
-
CCCC(OC(=O)C(CC)(CC)C(=O)OCC(F
)(F)C(F)(F)F)C(C)C - Molecular Weight1
- 390.39
- 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° | -1345.99 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1901.17 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 31.47 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.00 | kJ/mol | Joback Calculated Property |
| log10WS | -5.27 | Crippen Calculated Property | |
| logPoct/wat | 4.901 | Crippen Calculated Property | |
| McVol | 274.120 | ml/mol | McGowan Calculated Property |
| Pc | 1180.90 | kPa | Joback Calculated Property |
| Inp | 1431.00 | NIST | |
| Tboil | 726.72 | K | Joback Calculated Property |
| Tc | 900.63 | K | Joback Calculated Property |
| Tfus | 405.88 | K | Joback Calculated Property |
| Vc | 1.081 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [836.24; 917.68] | J/mol×K | [726.72; 900.63] | 
|
| Cp,gas | 836.24 | J/mol×K | 726.72 | Joback Calculated Property |
| Cp,gas | 851.98 | J/mol×K | 755.70 | Joback Calculated Property |
| Cp,gas | 866.79 | J/mol×K | 784.69 | Joback Calculated Property |
| Cp,gas | 880.73 | J/mol×K | 813.67 | Joback Calculated Property |
| Cp,gas | 893.82 | J/mol×K | 842.66 | Joback Calculated Property |
| Cp,gas | 906.13 | J/mol×K | 871.64 | Joback Calculated Property |
| Cp,gas | 917.68 | J/mol×K | 900.63 | Joback Calculated Property |
Similar Compounds
Sources
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