- InChI
- InChI=1S/C29H53F5O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-36-27(35)28(30,31)29(32,33)34/h2-26H2,1H3
- InChI Key
- PAKFICMSOWIPAA-UHFFFAOYSA-N
- Formula
- C29H53F5O2
- SMILES
-
CCCCCCCCCCCCCCCCCCCCCCCCCCOC(=
O)C(F)(F)C(F)(F)F - Molecular Weight1
- 528.72
- Other Names
-
- Hexacosyl 2,2,3,3,3-pentafluoropropanoate
- 1-Hexacosanol, pentafluoropropionate
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -1008.99 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1884.74 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 74.23 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.63 | kJ/mol | Joback Calculated Property |
| log10WS | -11.80 | Crippen Calculated Property | |
| logPoct/wat | 11.110 | Crippen Calculated Property | |
| McVol | 435.760 | ml/mol | McGowan Calculated Property |
| Pc | 582.60 | kPa | Joback Calculated Property |
| Inp | [2769.50; 2769.50] |
|
|
| Inp | 2769.50 | NIST | |
| Inp | 2769.50 | NIST | |
| Tboil | 929.10 | K | Joback Calculated Property |
| Tc | 1160.69 | K | Joback Calculated Property |
| Tfus | 496.54 | K | Joback Calculated Property |
| Vc | 1.752 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1515.63; 1646.70] | J/mol×K | [929.10; 1160.69] |
|
| Cp,gas | 1515.63 | J/mol×K | 929.10 | Joback Calculated Property |
| Cp,gas | 1541.19 | J/mol×K | 967.70 | Joback Calculated Property |
| Cp,gas | 1565.06 | J/mol×K | 1006.30 | Joback Calculated Property |
| Cp,gas | 1587.39 | J/mol×K | 1044.89 | Joback Calculated Property |
| Cp,gas | 1608.34 | J/mol×K | 1083.49 | Joback Calculated Property |
| Cp,gas | 1628.06 | J/mol×K | 1122.09 | Joback Calculated Property |
| Cp,gas | 1646.70 | J/mol×K | 1160.69 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Hexacosyl pentafluoropropionate.
Sources
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