- InChI
- InChI=1S/C21H30F8O4/c1-2-3-4-5-6-7-8-9-10-11-14-32-16(30)12-13-17(31)33-15-19(24,25)21(28,29)20(26,27)18(22)23/h10-11,18H,2-9,12-15H2,1H3/b11-10+
- InChI Key
- YBCYTKKSIOPIAB-ZHACJKMWSA-N
- Formula
- C21H30F8O4
- SMILES
-
CCCCCCCCCC=CCOC(=O)CCC(=O)OCC(
F)(F)C(F)(F)C(F)(F)C(F)F - Molecular Weight1
- 498.45
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.9974 | Relay (... Calculated Property | |
| ΔfG° | -1814.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2570.33 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 54.80 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 104.97 | kJ/mol | Relay (... Calculated Property |
| IE | 9.62 | eV | Relay (... Calculated Property |
| log10WS | -7.50 | Relay (... Calculated Property | |
| logPoct/wat | 6.721 | Crippen Calculated Property | |
| McVol | 331.490 | ml/mol | McGowan Calculated Property |
| Pc | 872.74 | kPa | Joback Calculated Property |
| Inp | [2219.00; 2219.00] |
|
|
| Inp | 2219.00 | NIST | |
| Inp | 2219.00 | NIST | |
| Tboil | 611.51 | K | Relay (... Calculated Property |
| Tc | 739.09 | K | Relay (... Calculated Property |
| Tfus | 289.30 | K | Relay (... Calculated Property |
| Vc | 1.226 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1066.60; 1150.67] | J/mol×K | [820.65; 1005.15] |
|
| Cp,gas | 1066.60 | J/mol×K | 820.65 | Joback Calculated Property |
| Cp,gas | 1082.85 | J/mol×K | 851.40 | Joback Calculated Property |
| Cp,gas | 1098.10 | J/mol×K | 882.15 | Joback Calculated Property |
| Cp,gas | 1112.44 | J/mol×K | 912.90 | Joback Calculated Property |
| Cp,gas | 1125.93 | J/mol×K | 943.65 | Joback Calculated Property |
| Cp,gas | 1138.65 | J/mol×K | 974.40 | Joback Calculated Property |
| Cp,gas | 1150.67 | J/mol×K | 1005.15 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, dodec-2-en-1-yl 2,2,3,3,4,4,5,5-octafluoropentyl ester.
Sources
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