- InChI
- InChI=1S/C11H13F9O2/c1-2-3-4-5-6-22-7(21)8(12,13)9(14,15)10(16,17)11(18,19)20/h2-6H2,1H3
- InChI Key
- FALKAIRAHKEYPI-UHFFFAOYSA-N
- Formula
- C11H13F9O2
- SMILES
-
CCCCCCOC(=O)C(F)(F)C(F)(F)C(F)
(F)C(F)(F)F - Molecular Weight1
- 348.21
- Other Names
-
- 2,2,3,3,4,4,5,5,5-Nonafluoro-pentanoic acid hexyl ester
- 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 | 0.6291 | Relay (... Calculated Property | |
| ΔfG° | -1934.11 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2391.17 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 25.10 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 57.25 | kJ/mol | Relay (... Calculated Property |
| IE | 10.64 | eV | Relay (... Calculated Property |
| log10WS | -5.70 | Relay (... Calculated Property | |
| logPoct/wat | 4.578 | Crippen Calculated Property | |
| McVol | 189.220 | ml/mol | McGowan Calculated Property |
| Pc | 1529.46 | kPa | Joback Calculated Property |
| Inp | [976.90; 977.00] |
|
|
| Inp | 977.00 | NIST | |
| Inp | 976.90 | NIST | |
| Tboil | 441.97 | K | Relay (... Calculated Property |
| Tc | 559.53 | K | Relay (... Calculated Property |
| Tfus | 216.87 | K | Relay (... Calculated Property |
| Vc | 0.730 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [500.04; 569.25] | J/mol×K | [507.88; 651.30] |
|
| Cp,gas | 500.04 | J/mol×K | 507.88 | Joback Calculated Property |
| Cp,gas | 513.33 | J/mol×K | 531.78 | Joback Calculated Property |
| Cp,gas | 525.87 | J/mol×K | 555.69 | Joback Calculated Property |
| Cp,gas | 537.71 | J/mol×K | 579.59 | Joback Calculated Property |
| Cp,gas | 548.86 | J/mol×K | 603.50 | Joback Calculated Property |
| Cp,gas | 559.36 | J/mol×K | 627.40 | Joback Calculated Property |
| Cp,gas | 569.25 | J/mol×K | 651.30 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Hexyl perfluoropentanoate.
Sources
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