- InChI
- InChI=1S/C12H19F3O2/c1-2-3-4-5-6-7-8-9-10-17-11(16)12(13,14)15/h8-9H,2-7,10H2,1H3/b9-8+
- InChI Key
- WBRGXAXCDNMVNG-CMDGGOBGSA-N
- Formula
- C12H19F3O2
- SMILES
- CCCCCCCC=CCOC(=O)C(F)(F)F
- Molecular Weight1
- 252.27
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfusH° | 33.23 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 65.37 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.95 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 4.009 | Crippen Calculated Property | |
| McVol | 188.390 | ml/mol | McGowan Calculated Property |
| Inp | [1253.50; 1253.50] |
|
|
| Inp | 1253.50 | NIST | |
| Inp | 1253.50 | NIST | |
| Tboil | 469.23 | K | Relay (1.0) Calculated Property |
| Tc | 606.48 | K | Relay (1.0) Calculated Property |
| Tfus | 223.58 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [466.47; 543.95] | J/mol×K | [531.12; 692.07] |
|
| Cp,gas | 466.47 | J/mol×K | 531.12 | Joback Calculated Property |
| Cp,gas | 481.05 | J/mol×K | 557.95 | Joback Calculated Property |
| Cp,gas | 494.94 | J/mol×K | 584.77 | Joback Calculated Property |
| Cp,gas | 508.14 | J/mol×K | 611.60 | Joback Calculated Property |
| Cp,gas | 520.70 | J/mol×K | 638.42 | Joback Calculated Property |
| Cp,gas | 532.63 | J/mol×K | 665.25 | Joback Calculated Property |
| Cp,gas | 543.95 | J/mol×K | 692.07 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to trans-2-Decen-1-ol, trifluoroacetate.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more.
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