- InChI
- InChI=1S/C15H15F15O2/c1-2-3-4-5-6-7-32-8(31)9(16,17)10(18,19)11(20,21)12(22,23)13(24,25)14(26,27)15(28,29)30/h2-7H2,1H3
- InChI Key
- SFLCAVLNVVENEX-UHFFFAOYSA-N
- Formula
- C15H15F15O2
- SMILES
-
CCCCCCCOC(=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
- 512.25
- 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 | 0.7810 | Relay (... Calculated Property | |
| ΔfG° | -3060.77 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -3651.66 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 31.70 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.14 | kJ/mol | Relay (... Calculated Property |
| IE | 10.53 | eV | Relay (... Calculated Property |
| log10WS | -8.08 | Relay (... Calculated Property | |
| logPoct/wat | 6.874 | Crippen Calculated Property | |
| McVol | 256.200 | ml/mol | McGowan Calculated Property |
| Pc | 1005.26 | kPa | Joback Calculated Property |
| Inp | 1204.00 | NIST | |
| Tboil | 501.71 | K | Relay (... Calculated Property |
| Tc | 616.22 | K | Relay (... Calculated Property |
| Tfus | 276.41 | K | Relay (... Calculated Property |
| Vc | 1.025 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [759.40; 831.56] | J/mol×K | [585.33; 723.28] | 
|
| Cp,gas | 759.40 | J/mol×K | 585.33 | Joback Calculated Property |
| Cp,gas | 773.51 | J/mol×K | 608.32 | Joback Calculated Property |
| Cp,gas | 786.71 | J/mol×K | 631.31 | Joback Calculated Property |
| Cp,gas | 799.07 | J/mol×K | 654.30 | Joback Calculated Property |
| Cp,gas | 810.63 | J/mol×K | 677.30 | Joback Calculated Property |
| Cp,gas | 821.44 | J/mol×K | 700.29 | Joback Calculated Property |
| Cp,gas | 831.56 | J/mol×K | 723.28 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Pentadecafluorooctanoic acid, heptyl ester.
Sources
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