- InChI
- InChI=1S/C26H37F5O4/c1-2-3-4-5-6-7-8-9-10-14-17-34-20(32)15-12-11-13-16-21(33)35-18-19-22(27)24(29)26(31)25(30)23(19)28/h2-18H2,1H3
- InChI Key
- RBGZADSOMBVRTL-UHFFFAOYSA-N
- Formula
- C26H37F5O4
- SMILES
-
CCCCCCCCCCCCOC(=O)CCCCCC(=O)OC
c1c(F)c(F)c(F)c(F)c1F - Molecular Weight1
- 508.56
- 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° | -1209.59 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1870.94 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 76.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 93.28 | kJ/mol | Joback Calculated Property |
| log10WS | -9.69 | Crippen Calculated Property | |
| logPoct/wat | 7.840 | Crippen Calculated Property | |
| McVol | 377.170 | ml/mol | McGowan Calculated Property |
| Pc | 775.48 | kPa | Joback Calculated Property |
| Inp | [2993.00; 2993.00] |
|
|
| Inp | 2993.00 | NIST | |
| Inp | 2993.00 | NIST | |
| Tboil | 994.79 | K | Joback Calculated Property |
| Tc | 1234.18 | K | Joback Calculated Property |
| Tfus | 619.07 | K | Joback Calculated Property |
| Vc | 1.522 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1274.97; 1351.51] | J/mol×K | [994.79; 1234.18] |
|
| Cp,gas | 1274.97 | J/mol×K | 994.79 | Joback Calculated Property |
| Cp,gas | 1292.38 | J/mol×K | 1034.69 | Joback Calculated Property |
| Cp,gas | 1307.88 | J/mol×K | 1074.59 | Joback Calculated Property |
| Cp,gas | 1321.50 | J/mol×K | 1114.49 | Joback Calculated Property |
| Cp,gas | 1333.29 | J/mol×K | 1154.38 | Joback Calculated Property |
| Cp,gas | 1343.28 | J/mol×K | 1194.28 | Joback Calculated Property |
| Cp,gas | 1351.51 | J/mol×K | 1234.18 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Pimelic acid, dodecyl pentafluorobenzyl ester.
Sources
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