- InChI
- InChI=1S/C7H3F11O2/c1-20-2(19)3(8,9)4(10,11)5(12,13)6(14,15)7(16,17)18/h1H3
- InChI Key
- NJXMLQHJFDKLKL-UHFFFAOYSA-N
- Formula
- C7H3F11O2
- SMILES
-
COC(=O)C(F)(F)C(F)(F)C(F)(F)C(
F)(F)C(F)(F)F - Molecular Weight1
- 328.08
- Other Names
-
- 2,2,3,3,4,4,5,5,6,6,6-Undecafluoro- hexanoic acid methyl ester
- 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° | -2354.57 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2633.57 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 13.48 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 24.87 | kJ/mol | Joback Calculated Property |
| log10WS | -3.53 | Crippen Calculated Property | |
| logPoct/wat | 3.263 | Crippen Calculated Property | |
| McVol | 136.400 | ml/mol | McGowan Calculated Property |
| Pc | 1985.89 | kPa | Joback Calculated Property |
| Inp | [595.70; 596.00] |
|
|
| Inp | 596.00 | NIST | |
| Inp | 595.70 | NIST | |
| Inp | 596.00 | NIST | |
| Tboil | 411.67 | K | Joback Calculated Property |
| Tc | 548.72 | K | Joback Calculated Property |
| Tfus | 259.40 | K | Joback Calculated Property |
| Vc | 0.595 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [339.47; 396.88] | J/mol×K | [411.67; 548.72] |
|
| Cp,gas | 339.47 | J/mol×K | 411.67 | Joback Calculated Property |
| Cp,gas | 350.78 | J/mol×K | 434.51 | Joback Calculated Property |
| Cp,gas | 361.35 | J/mol×K | 457.35 | Joback Calculated Property |
| Cp,gas | 371.22 | J/mol×K | 480.19 | Joback Calculated Property |
| Cp,gas | 380.41 | J/mol×K | 503.03 | Joback Calculated Property |
| Cp,gas | 388.95 | J/mol×K | 525.88 | Joback Calculated Property |
| Cp,gas | 396.88 | J/mol×K | 548.72 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Methyl perfluorohexanoate.
Sources
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