- InChI
- InChI=1S/C19H21F15O2/c1-2-3-4-5-6-7-8-9-10-11-36-12(35)13(20,21)14(22,23)15(24,25)16(26,27)17(28,29)18(30,31)19(32,33)34/h9-10H,2-8,11H2,1H3/b10-9+
- InChI Key
- KWQWVJBGFXFMEX-MDZDMXLPSA-N
- Formula
- C19H21F15O2
- SMILES
-
CCCCCCCCC=CCOC(=O)C(F)(F)C(F)(
F)C(F)(F)C(F)(F)C(F)(F)C(F)(F) C(F)(F)F - Molecular Weight1
- 566.34
- 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° | -2946.87 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -3565.97 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 42.26 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 45.67 | kJ/mol | Joback Calculated Property |
| log10WS | -9.04 | Crippen Calculated Property | |
| logPoct/wat | 8.211 | Crippen Calculated Property | |
| McVol | 308.260 | ml/mol | McGowan Calculated Property |
| Pc | 822.90 | kPa | Joback Calculated Property |
| Inp | 1543.00 | NIST | |
| Tboil | 681.01 | K | Joback Calculated Property |
| Tc | 834.30 | K | Joback Calculated Property |
| Tfus | 396.76 | K | Joback Calculated Property |
| Vc | 1.296 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [957.24; 1033.47] | J/mol×K | [681.01; 834.30] | 
|
| Cp,gas | 957.24 | J/mol×K | 681.01 | Joback Calculated Property |
| Cp,gas | 972.12 | J/mol×K | 706.56 | Joback Calculated Property |
| Cp,gas | 986.02 | J/mol×K | 732.11 | Joback Calculated Property |
| Cp,gas | 999.03 | J/mol×K | 757.65 | Joback Calculated Property |
| Cp,gas | 1011.22 | J/mol×K | 783.20 | Joback Calculated Property |
| Cp,gas | 1022.68 | J/mol×K | 808.75 | Joback Calculated Property |
| Cp,gas | 1033.47 | J/mol×K | 834.30 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Pentadecafluorooctanoic acid, undec-2-en-1-yl ester.
Sources
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