- InChI
- InChI=1S/C26H48O4/c1-5-7-8-9-10-11-12-13-14-17-20-29-25(27)22-18-15-16-19-23(22)26(28)30-24(6-2)21(3)4/h21-24H,5-20H2,1-4H3
- InChI Key
- QOKKJVWLZSKILP-UHFFFAOYSA-N
- Formula
- C26H48O4
- SMILES
-
CCCCCCCCCCCCOC(=O)C1CCCCC1C(=O
)OC(CC)C(C)C - Molecular Weight1
- 424.66
- 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° | -287.94 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1046.15 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 54.53 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.13 | kJ/mol | Joback Calculated Property |
| log10WS | -7.71 | Crippen Calculated Property | |
| logPoct/wat | 7.235 | Crippen Calculated Property | |
| McVol | 381.220 | ml/mol | McGowan Calculated Property |
| Pc | 848.01 | kPa | Joback Calculated Property |
| Inp | [2877.00; 2877.00] |
|
|
| Inp | 2877.00 | NIST | |
| Inp | 2877.00 | NIST | |
| Tboil | 960.86 | K | Joback Calculated Property |
| Tc | 1176.44 | K | Joback Calculated Property |
| Tfus | 500.24 | K | Joback Calculated Property |
| Vc | 1.460 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1346.89; 1439.93] | J/mol×K | [960.86; 1176.44] |
|
| Cp,gas | 1346.89 | J/mol×K | 960.86 | Joback Calculated Property |
| Cp,gas | 1366.85 | J/mol×K | 996.79 | Joback Calculated Property |
| Cp,gas | 1384.97 | J/mol×K | 1032.72 | Joback Calculated Property |
| Cp,gas | 1401.30 | J/mol×K | 1068.65 | Joback Calculated Property |
| Cp,gas | 1415.87 | J/mol×K | 1104.58 | Joback Calculated Property |
| Cp,gas | 1428.74 | J/mol×K | 1140.51 | Joback Calculated Property |
| Cp,gas | 1439.93 | J/mol×K | 1176.44 | Joback Calculated Property |
| η | [0.0000245; 0.0006680] | Pa×s | [500.24; 960.86] |
|
| η | 0.0006680 | Pa×s | 500.24 | Joback Calculated Property |
| η | 0.0002670 | Pa×s | 577.01 | Joback Calculated Property |
| η | 0.0001324 | Pa×s | 653.78 | Joback Calculated Property |
| η | 0.0000761 | Pa×s | 730.55 | Joback Calculated Property |
| η | 0.0000486 | Pa×s | 807.32 | Joback Calculated Property |
| η | 0.0000335 | Pa×s | 884.09 | Joback Calculated Property |
| η | 0.0000245 | Pa×s | 960.86 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, dodecyl 2-methylpent-3-yl ester.
Sources
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