- InChI
- InChI=1S/C26H42F2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-30-26(29)24-20-19-23(27)22-25(24)28/h19-20,22H,2-18,21H2,1H3
- InChI Key
- SBGXAPGVTQOVQD-UHFFFAOYSA-N
- Formula
- C26H42F2O2
- SMILES
-
CCCCCCCCCCCCCCCCCCCOC(=O)c1ccc
(F)cc1F - Molecular Weight1
- 424.61
- 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° | -362.35 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1003.40 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 65.31 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.59 | kJ/mol | Joback Calculated Property |
| log10WS | -9.91 | Crippen Calculated Property | |
| logPoct/wat | 8.773 | Crippen Calculated Property | |
| McVol | 364.420 | ml/mol | McGowan Calculated Property |
| Pc | 836.76 | kPa | Joback Calculated Property |
| Inp | [2897.00; 2897.00] |
|
|
| Inp | 2897.00 | NIST | |
| Inp | 2897.00 | NIST | |
| Tboil | 905.75 | K | Joback Calculated Property |
| Tc | 1109.25 | K | Joback Calculated Property |
| Tfus | 507.58 | K | Joback Calculated Property |
| Vc | 1.444 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1206.66; 1305.33] | J/mol×K | [905.75; 1109.25] |
|
| Cp,gas | 1206.66 | J/mol×K | 905.75 | Joback Calculated Property |
| Cp,gas | 1226.19 | J/mol×K | 939.67 | Joback Calculated Property |
| Cp,gas | 1244.42 | J/mol×K | 973.58 | Joback Calculated Property |
| Cp,gas | 1261.40 | J/mol×K | 1007.50 | Joback Calculated Property |
| Cp,gas | 1277.17 | J/mol×K | 1041.42 | Joback Calculated Property |
| Cp,gas | 1291.80 | J/mol×K | 1075.34 | Joback Calculated Property |
| Cp,gas | 1305.33 | J/mol×K | 1109.25 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,4-Difluorobenzoic acid, nonadecyl ester.
Sources
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