- InChI
- InChI=1S/C8H11F3O2/c1-2-3-4-5-6-13-7(12)8(9,10)11/h2H,1,3-6H2
- InChI Key
- JSEHMFGRGCOJOF-UHFFFAOYSA-N
- Formula
- C8H11F3O2
- SMILES
- C=CCCCCOC(=O)C(F)(F)F
- Molecular Weight1
- 196.17
- 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 | 0.4443 | Relay (1.0) Calculated Property | |
| ΔfG° | -711.19 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -984.83 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 19.81 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.86 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.38 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.94 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.448 | Crippen Calculated Property | |
| McVol | 132.030 | ml/mol | McGowan Calculated Property |
| Pc | 2465.36 | kPa | Joback Calculated Property |
| Inp | 857.20 | NIST | |
| Tboil | 417.10 | K | Relay (1.0) Calculated Property |
| Tc | 541.85 | K | Relay (1.0) Calculated Property |
| Tfus | 211.42 | K | Relay (1.0) Calculated Property |
| Vc | 0.474 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [290.56; 349.76] | J/mol×K | [449.99; 613.13] | 
|
| Cp,gas | 290.56 | J/mol×K | 449.99 | Joback Calculated Property |
| Cp,gas | 301.65 | J/mol×K | 477.18 | Joback Calculated Property |
| Cp,gas | 312.23 | J/mol×K | 504.37 | Joback Calculated Property |
| Cp,gas | 322.32 | J/mol×K | 531.56 | Joback Calculated Property |
| Cp,gas | 331.93 | J/mol×K | 558.75 | Joback Calculated Property |
| Cp,gas | 341.07 | J/mol×K | 585.94 | Joback Calculated Property |
| Cp,gas | 349.76 | J/mol×K | 613.13 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 5-Hexen-1-ol, trifluoroacetate.
Sources
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