- InChI
- InChI=1S/C15H23F5O2/c1-2-3-4-5-6-7-8-9-10-11-12-22-13(21)14(16,17)15(18,19)20/h10-11H,2-9,12H2,1H3/b11-10+
- InChI Key
- XQULQGQTCWDDGX-ZHACJKMWSA-N
- Formula
- C15H23F5O2
- SMILES
-
CCCCCCCCCC=CCOC(=O)C(F)(F)C(F)
(F)F - Molecular Weight1
- 330.33
- 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 | 0.6872 | Relay (1.0) Calculated Property | |
| ΔfG° | -1046.65 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1598.72 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 38.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.57 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.00 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.26 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.424 | Crippen Calculated Property | |
| McVol | 234.200 | ml/mol | McGowan Calculated Property |
| Pc | 1325.20 | kPa | Joback Calculated Property |
| Inp | [1443.10; 1443.10] |
|
|
| Inp | 1443.10 | NIST | |
| Inp | 1443.10 | NIST | |
| Tboil | 491.54 | K | Relay (1.0) Calculated Property |
| Tc | 619.98 | K | Relay (1.0) Calculated Property |
| Tfus | 236.83 | K | Relay (1.0) Calculated Property |
| Vc | 0.857 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [645.98; 727.03] | J/mol×K | [612.94; 771.32] |
|
| Cp,gas | 645.98 | J/mol×K | 612.94 | Joback Calculated Property |
| Cp,gas | 661.30 | J/mol×K | 639.34 | Joback Calculated Property |
| Cp,gas | 675.84 | J/mol×K | 665.73 | Joback Calculated Property |
| Cp,gas | 689.65 | J/mol×K | 692.13 | Joback Calculated Property |
| Cp,gas | 702.76 | J/mol×K | 718.53 | Joback Calculated Property |
| Cp,gas | 715.21 | J/mol×K | 744.92 | Joback Calculated Property |
| Cp,gas | 727.03 | J/mol×K | 771.32 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to trans-2-Dodecen-1-ol, pentafluoropropionate.
Sources
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