- InChI
- InChI=1S/C34H65F3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-39-33(38)34(35,36)37/h2-32H2,1H3
- InChI Key
- ZKTKQWPZEBJTKD-UHFFFAOYSA-N
- Formula
- C34H65F3O2
- SMILES
-
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
CCOC(=O)C(F)(F)F - Molecular Weight1
- 562.87
- Other Names
-
- Dotriacontyl 2,2,2-trifluoroacetate
- 1-Dotriacontanol, trifluoroacetate
- 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 | 1.4408 | Relay (1.0) Calculated Property | |
| ΔfG° | -580.11 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1620.65 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 88.43 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 159.55 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.91 | eV | Relay (1.0) Calculated Property |
| log10WS | -11.29 | Relay (1.0) Calculated Property | |
| logPoct/wat | 12.815 | Crippen Calculated Property | |
| McVol | 502.670 | ml/mol | McGowan Calculated Property |
| Pc | 482.61 | kPa | Joback Calculated Property |
| Inp | 3371.30 | NIST | |
| Tboil | 684.53 | K | Relay (1.0) Calculated Property |
| Tc | 821.77 | K | Relay (1.0) Calculated Property |
| Tfus | 329.53 | K | Relay (1.0) Calculated Property |
| Vc | 1.953 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1837.04; 1997.35] | J/mol×K | [1048.19; 1358.23] | 
|
| Cp,gas | 1837.04 | J/mol×K | 1048.19 | Joback Calculated Property |
| Cp,gas | 1869.77 | J/mol×K | 1099.86 | Joback Calculated Property |
| Cp,gas | 1899.64 | J/mol×K | 1151.54 | Joback Calculated Property |
| Cp,gas | 1926.98 | J/mol×K | 1203.21 | Joback Calculated Property |
| Cp,gas | 1952.15 | J/mol×K | 1254.88 | Joback Calculated Property |
| Cp,gas | 1975.50 | J/mol×K | 1306.55 | Joback Calculated Property |
| Cp,gas | 1997.35 | J/mol×K | 1358.23 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dotriacontyl trifluoroacetate.
Sources
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