- InChI
- InChI=1S/C15H16F8O4/c1-3-5-9(4-2)27-11(25)7-6-10(24)26-8-13(18,19)15(22,23)14(20,21)12(16)17/h9,12H,4,6-8H2,1-2H3
- InChI Key
- LOCOSRAVXITGRH-UHFFFAOYSA-N
- Formula
- C15H16F8O4
- SMILES
-
CC#CC(CC)OC(=O)CCC(=O)OCC(F)(F
)C(F)(F)C(F)(F)C(F)F - Molecular Weight1
- 412.27
- 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° | -1744.46 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2175.92 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 38.65 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.25 | kJ/mol | Joback Calculated Property |
| log10WS | -4.99 | Crippen Calculated Property | |
| logPoct/wat | 3.826 | Crippen Calculated Property | |
| McVol | 242.650 | ml/mol | McGowan Calculated Property |
| Pc | 1378.88 | kPa | Joback Calculated Property |
| Inp | [1620.00; 1620.00] |
|
|
| Inp | 1620.00 | NIST | |
| Inp | 1620.00 | NIST | |
| Tboil | 687.77 | K | Joback Calculated Property |
| Tc | 858.02 | K | Joback Calculated Property |
| Tfus | 491.21 | K | Joback Calculated Property |
| Vc | 0.985 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [704.46; 770.87] | J/mol×K | [687.77; 858.02] |
|
| Cp,gas | 704.46 | J/mol×K | 687.77 | Joback Calculated Property |
| Cp,gas | 717.40 | J/mol×K | 716.14 | Joback Calculated Property |
| Cp,gas | 729.54 | J/mol×K | 744.52 | Joback Calculated Property |
| Cp,gas | 740.92 | J/mol×K | 772.89 | Joback Calculated Property |
| Cp,gas | 751.57 | J/mol×K | 801.27 | Joback Calculated Property |
| Cp,gas | 761.54 | J/mol×K | 829.64 | Joback Calculated Property |
| Cp,gas | 770.87 | J/mol×K | 858.02 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, hex-4-yn-3-yl 2,2,3,3,4,4,5,5-octafluoropentyl ester.
Sources
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