- InChI
- InChI=1S/C26H39ClO4/c1-2-3-4-5-6-7-8-9-10-15-20-30-25(28)21-16-11-12-17-22(21)26(29)31-24-19-14-13-18-23(24)27/h13-14,18-19,21-22H,2-12,15-17,20H2,1H3
- InChI Key
- SANGHKSWEYCKSW-UHFFFAOYSA-N
- Formula
- C26H39ClO4
- SMILES
-
CCCCCCCCCCCCOC(=O)C1CCCCC1C(=O
)Oc1ccccc1Cl - Molecular Weight1
- 451.04
- 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° | -192.21 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -826.27 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 59.42 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 99.22 | kJ/mol | Joback Calculated Property |
| log10WS | -8.28 | Crippen Calculated Property | |
| logPoct/wat | 7.516 | Crippen Calculated Property | |
| McVol | 369.700 | ml/mol | McGowan Calculated Property |
| Pc | 994.51 | kPa | Joback Calculated Property |
| Inp | [3233.00; 3233.00] |
|
|
| Inp | 3233.00 | NIST | |
| Inp | 3233.00 | NIST | |
| Tboil | 1030.83 | K | Joback Calculated Property |
| Tc | 1262.35 | K | Joback Calculated Property |
| Tfus | 599.10 | K | Joback Calculated Property |
| Vc | 1.413 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1267.65; 1331.84] | J/mol×K | [1030.83; 1262.35] |
|
| Cp,gas | 1267.65 | J/mol×K | 1030.83 | Joback Calculated Property |
| Cp,gas | 1282.80 | J/mol×K | 1069.42 | Joback Calculated Property |
| Cp,gas | 1296.10 | J/mol×K | 1108.00 | Joback Calculated Property |
| Cp,gas | 1307.60 | J/mol×K | 1146.59 | Joback Calculated Property |
| Cp,gas | 1317.35 | J/mol×K | 1185.18 | Joback Calculated Property |
| Cp,gas | 1325.41 | J/mol×K | 1223.77 | Joback Calculated Property |
| Cp,gas | 1331.84 | J/mol×K | 1262.35 | Joback Calculated Property |
| η | [0.0000265; 0.0003115] | Pa×s | [599.10; 1030.83] |
|
| η | 0.0003115 | Pa×s | 599.10 | Joback Calculated Property |
| η | 0.0001657 | Pa×s | 671.05 | Joback Calculated Property |
| η | 0.0000996 | Pa×s | 743.01 | Joback Calculated Property |
| η | 0.0000655 | Pa×s | 814.96 | Joback Calculated Property |
| η | 0.0000461 | Pa×s | 886.92 | Joback Calculated Property |
| η | 0.0000342 | Pa×s | 958.87 | Joback Calculated Property |
| η | 0.0000265 | Pa×s | 1030.83 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, 2-chlorophenyl dodecyl ester.
Sources
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