- InChI
- InChI=1S/C25H41F7O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21(33)35-2)36-22(34)23(26,27)24(28,29)25(30,31)32/h20H,3-19H2,1-2H3
- InChI Key
- KJVXKRLFFXIGKP-UHFFFAOYSA-N
- Formula
- C25H41F7O4
- SMILES
-
CCCCCCCCCCCCCCCCCCC(OC(=O)C(F)
(F)C(F)(F)C(F)(F)F)C(=O)OC - Molecular Weight1
- 538.58
- 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 | 1.1528 | Relay (1.0) Calculated Property | |
| ΔfG° | -1665.81 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2562.34 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 61.87 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 120.80 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.54 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.58 | Relay (1.0) Calculated Property | |
| logPoct/wat | 8.556 | Crippen Calculated Property | |
| McVol | 390.380 | ml/mol | McGowan Calculated Property |
| Pc | 701.35 | kPa | Joback Calculated Property |
| Inp | 2374.00 | NIST | |
| Tboil | 609.44 | K | Relay (1.0) Calculated Property |
| Tc | 732.32 | K | Relay (1.0) Calculated Property |
| Tfus | 304.07 | K | Relay (1.0) Calculated Property |
| Vc | 1.469 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1330.44; 1431.72] | J/mol×K | [908.74; 1123.90] | 
|
| Cp,gas | 1330.44 | J/mol×K | 908.74 | Joback Calculated Property |
| Cp,gas | 1350.41 | J/mol×K | 944.60 | Joback Calculated Property |
| Cp,gas | 1368.99 | J/mol×K | 980.46 | Joback Calculated Property |
| Cp,gas | 1386.30 | J/mol×K | 1016.32 | Joback Calculated Property |
| Cp,gas | 1402.45 | J/mol×K | 1052.18 | Joback Calculated Property |
| Cp,gas | 1417.55 | J/mol×K | 1088.04 | Joback Calculated Property |
| Cp,gas | 1431.72 | J/mol×K | 1123.90 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to «alpha»-Hydroxyarachidic acid, HFB-Me.
Sources
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