- InChI
- InChI=1S/C15H25F3O5/c1-11(7-9-21-3)8-10-22-13(19)5-4-6-14(20)23-12(2)15(16,17)18/h11-12H,4-10H2,1-3H3
- InChI Key
- AENBGEZITJXMQF-UHFFFAOYSA-N
- Formula
- C15H25F3O5
- SMILES
-
COCCC(C)CCOC(=O)CCCC(=O)OC(C)C
(F)(F)F - Molecular Weight1
- 342.35
- 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° | -1083.89 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1582.39 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 36.15 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 65.18 | kJ/mol | Joback Calculated Property |
| log10WS | -3.45 | Crippen Calculated Property | |
| logPoct/wat | 3.257 | Crippen Calculated Property | |
| McVol | 248.270 | ml/mol | McGowan Calculated Property |
| Pc | 1389.18 | kPa | Joback Calculated Property |
| Inp | 1703.00 | NIST | |
| Tboil | 711.30 | K | Joback Calculated Property |
| Tc | 883.61 | K | Joback Calculated Property |
| Tfus | 399.55 | K | Joback Calculated Property |
| Vc | 0.973 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [733.25; 812.47] | J/mol×K | [711.30; 883.61] | 
|
| Cp,gas | 733.25 | J/mol×K | 711.30 | Joback Calculated Property |
| Cp,gas | 748.43 | J/mol×K | 740.02 | Joback Calculated Property |
| Cp,gas | 762.81 | J/mol×K | 768.74 | Joback Calculated Property |
| Cp,gas | 776.39 | J/mol×K | 797.46 | Joback Calculated Property |
| Cp,gas | 789.19 | J/mol×K | 826.18 | Joback Calculated Property |
| Cp,gas | 801.21 | J/mol×K | 854.89 | Joback Calculated Property |
| Cp,gas | 812.47 | J/mol×K | 883.61 | Joback Calculated Property |
Similar Compounds
Sources
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