- InChI
- InChI=1S/C28H52O4/c1-3-5-7-9-10-11-12-13-14-15-16-20-24-32-28(30)26-22-18-17-21-25(26)27(29)31-23-19-8-6-4-2/h25-26H,3-24H2,1-2H3
- InChI Key
- XJAOFGPMMGBRBI-UHFFFAOYSA-N
- Formula
- C28H52O4
- SMILES
-
CCCCCCCCCCCCCCOC(=O)C1CCCCC1C(
=O)OCCCCCC - Molecular Weight1
- 452.71
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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° | -266.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1076.87 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 66.76 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 96.35 | kJ/mol | Joback Calculated Property |
| log10WS | -8.68 | Crippen Calculated Property | |
| logPoct/wat | 8.161 | Crippen Calculated Property | |
| McVol | 409.400 | ml/mol | McGowan Calculated Property |
| Pc | 753.91 | kPa | Joback Calculated Property |
| Inp | [3141.00; 3141.00] |
|
|
| Inp | 3141.00 | NIST | |
| Inp | 3141.00 | NIST | |
| Tboil | 1007.50 | K | Joback Calculated Property |
| Tc | 1238.90 | K | Joback Calculated Property |
| Tfus | 552.78 | K | Joback Calculated Property |
| Vc | 1.583 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1474.90; 1567.79] | J/mol×K | [1007.50; 1238.90] |
|
| Cp,gas | 1474.90 | J/mol×K | 1007.50 | Joback Calculated Property |
| Cp,gas | 1495.49 | J/mol×K | 1046.07 | Joback Calculated Property |
| Cp,gas | 1513.96 | J/mol×K | 1084.63 | Joback Calculated Property |
| Cp,gas | 1530.36 | J/mol×K | 1123.20 | Joback Calculated Property |
| Cp,gas | 1544.76 | J/mol×K | 1161.77 | Joback Calculated Property |
| Cp,gas | 1557.22 | J/mol×K | 1200.34 | Joback Calculated Property |
| Cp,gas | 1567.79 | J/mol×K | 1238.90 | Joback Calculated Property |
| η | [0.0000218; 0.0003982] | Pa×s | [552.78; 1007.50] |
|
| η | 0.0003982 | Pa×s | 552.78 | Joback Calculated Property |
| η | 0.0001832 | Pa×s | 628.57 | Joback Calculated Property |
| η | 0.0000996 | Pa×s | 704.35 | Joback Calculated Property |
| η | 0.0000610 | Pa×s | 780.14 | Joback Calculated Property |
| η | 0.0000407 | Pa×s | 855.93 | Joback Calculated Property |
| η | 0.0000290 | Pa×s | 931.71 | Joback Calculated Property |
| η | 0.0000218 | Pa×s | 1007.50 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, hexyl tetradecyl ester.
Sources
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