- 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
- 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 | 0.5623 | Relay (1.0) Calculated Property | |
| ΔfG° | -685.13 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1110.14 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 31.65 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.10 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.95 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.21 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.009 | Crippen Calculated Property | |
| McVol | 188.390 | ml/mol | McGowan Calculated Property |
| Pc | 1753.60 | kPa | Joback 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 | 602.01 | K | Relay (1.0) Calculated Property |
| Tfus | 224.14 | K | Relay (1.0) Calculated Property |
| Vc | 0.685 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [473.19; 549.14] | J/mol×K | [548.99; 712.64] |
|
| Cp,gas | 473.19 | J/mol×K | 548.99 | Joback Calculated Property |
| Cp,gas | 487.45 | J/mol×K | 576.26 | Joback Calculated Property |
| Cp,gas | 501.03 | J/mol×K | 603.54 | Joback Calculated Property |
| Cp,gas | 513.97 | J/mol×K | 630.81 | Joback Calculated Property |
| Cp,gas | 526.28 | J/mol×K | 658.09 | Joback Calculated Property |
| Cp,gas | 538.00 | J/mol×K | 685.36 | Joback Calculated Property |
| Cp,gas | 549.14 | J/mol×K | 712.64 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to trans-2-Decen-1-ol, trifluoroacetate.
Sources
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