- InChI
- InChI=1S/C16H23F7O2/c1-2-3-4-5-6-7-8-9-10-11-12-25-13(24)14(17,18)15(19,20)16(21,22)23/h10-11H,2-9,12H2,1H3/b11-10+
- InChI Key
- KZMYZWHQTQVIND-ZHACJKMWSA-N
- Formula
- C16H23F7O2
- SMILES
-
CCCCCCCCCC=CCOC(=O)C(F)(F)C(F)
(F)C(F)(F)F - Molecular Weight1
- 380.34
- 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 | 0.7243 | Relay (1.0) Calculated Property | |
| ΔfG° | -1425.01 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2013.52 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 39.50 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.38 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.95 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.83 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.059 | Crippen Calculated Property | |
| McVol | 251.830 | ml/mol | McGowan Calculated Property |
| Pc | 1177.66 | kPa | Joback Calculated Property |
| Inp | 1481.20 | NIST | |
| Tboil | 501.85 | K | Relay (1.0) Calculated Property |
| Tc | 623.95 | K | Relay (1.0) Calculated Property |
| Tfus | 228.28 | K | Relay (1.0) Calculated Property |
| Vc | 0.924 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [718.39; 798.59] | J/mol×K | [631.13; 786.52] | 
|
| Cp,gas | 718.39 | J/mol×K | 631.13 | Joback Calculated Property |
| Cp,gas | 733.65 | J/mol×K | 657.03 | Joback Calculated Property |
| Cp,gas | 748.09 | J/mol×K | 682.93 | Joback Calculated Property |
| Cp,gas | 761.77 | J/mol×K | 708.83 | Joback Calculated Property |
| Cp,gas | 774.71 | J/mol×K | 734.73 | Joback Calculated Property |
| Cp,gas | 786.97 | J/mol×K | 760.62 | Joback Calculated Property |
| Cp,gas | 798.59 | J/mol×K | 786.52 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to trans-2-Dodecen-1-ol, heptafluorobutyrate.
Sources
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