- InChI
- InChI=1S/C28H44O4/c1-4-5-6-7-8-9-10-11-12-15-20-31-27(29)24-16-13-14-17-25(24)28(30)32-26-21-22(2)18-19-23(26)3/h18-19,21,24-25H,4-17,20H2,1-3H3
- InChI Key
- ODVZOVYJHMPYGG-UHFFFAOYSA-N
- Formula
- C28H44O4
- SMILES
-
CCCCCCCCCCCCOC(=O)C1CCCCC1C(=O
)Oc1cc(C)ccc1C - Molecular Weight1
- 444.65
- 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° | -173.07 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -863.28 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 60.02 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 99.95 | kJ/mol | Joback Calculated Property |
| log10WS | -8.55 | Crippen Calculated Property | |
| logPoct/wat | 7.479 | Crippen Calculated Property | |
| McVol | 385.640 | ml/mol | McGowan Calculated Property |
| Pc | 895.87 | kPa | Joback Calculated Property |
| Inp | [3214.00; 3214.00] |
|
|
| Inp | 3214.00 | NIST | |
| Inp | 3214.00 | NIST | |
| Tboil | 1044.14 | K | Joback Calculated Property |
| Tc | 1278.45 | K | Joback Calculated Property |
| Tfus | 604.24 | K | Joback Calculated Property |
| Vc | 1.476 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1367.10; 1435.83] | J/mol×K | [1044.14; 1278.45] |
|
| Cp,gas | 1367.10 | J/mol×K | 1044.14 | Joback Calculated Property |
| Cp,gas | 1383.48 | J/mol×K | 1083.19 | Joback Calculated Property |
| Cp,gas | 1397.83 | J/mol×K | 1122.24 | Joback Calculated Property |
| Cp,gas | 1410.18 | J/mol×K | 1161.30 | Joback Calculated Property |
| Cp,gas | 1420.59 | J/mol×K | 1200.35 | Joback Calculated Property |
| Cp,gas | 1429.13 | J/mol×K | 1239.40 | Joback Calculated Property |
| Cp,gas | 1435.83 | J/mol×K | 1278.45 | Joback Calculated Property |
| η | [0.0000240; 0.0002732] | Pa×s | [604.24; 1044.14] |
|
| η | 0.0002732 | Pa×s | 604.24 | Joback Calculated Property |
| η | 0.0001462 | Pa×s | 677.56 | Joback Calculated Property |
| η | 0.0000884 | Pa×s | 750.87 | Joback Calculated Property |
| η | 0.0000585 | Pa×s | 824.19 | Joback Calculated Property |
| η | 0.0000414 | Pa×s | 897.51 | Joback Calculated Property |
| η | 0.0000308 | Pa×s | 970.82 | Joback Calculated Property |
| η | 0.0000240 | Pa×s | 1044.14 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, 2,5-dimethylphenyl dodecyl ester.
Sources
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