- InChI
- InChI=1S/C7H11F3O2/c1-3-4-5(2)12-6(11)7(8,9)10/h5H,3-4H2,1-2H3
- InChI Key
- HENNKZFOVKJQDI-UHFFFAOYSA-N
- Formula
- C7H11F3O2
- SMILES
- CCCC(C)OC(=O)C(F)(F)F
- Molecular Weight1
- 184.16
- CAS
- 90991-71-2
- 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° | -809.89 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1034.97 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 14.98 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 36.20 | kJ/mol | Joback Calculated Property |
| log10WS | -2.39 | Crippen Calculated Property | |
| logPoct/wat | 2.280 | Crippen Calculated Property | |
| McVol | 122.240 | ml/mol | McGowan Calculated Property |
| Pc | 2624.46 | kPa | Joback Calculated Property |
| Inp | [747.50; 747.50] |
|
|
| Inp | 747.50 | NIST | |
| Inp | 747.50 | NIST | |
| Tboil | 429.99 | K | Joback Calculated Property |
| Tc | 594.24 | K | Joback Calculated Property |
| Tfus | 230.00 | K | Joback Calculated Property |
| Vc | 0.488 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [265.92; 324.86] | J/mol×K | [429.99; 594.24] |
|
| Cp,gas | 265.92 | J/mol×K | 429.99 | Joback Calculated Property |
| Cp,gas | 276.90 | J/mol×K | 457.36 | Joback Calculated Property |
| Cp,gas | 287.40 | J/mol×K | 484.74 | Joback Calculated Property |
| Cp,gas | 297.44 | J/mol×K | 512.11 | Joback Calculated Property |
| Cp,gas | 307.02 | J/mol×K | 539.49 | Joback Calculated Property |
| Cp,gas | 316.16 | J/mol×K | 566.86 | Joback Calculated Property |
| Cp,gas | 324.86 | J/mol×K | 594.24 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Pentanol, trifluoroacetate.
Sources
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