- InChI
- InChI=1S/C26H50O4/c1-5-7-9-11-13-14-15-16-17-19-21-23-30-25(28)26(3,4)24(27)29-22-20-18-12-10-8-6-2/h5-23H2,1-4H3
- InChI Key
- ITYVPRAWCXBNPY-UHFFFAOYSA-N
- Formula
- C26H50O4
- SMILES
-
CCCCCCCCCCCCCOC(=O)C(C)(C)C(=O
)OCCCCCCCC - Molecular Weight1
- 426.67
- 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° | -296.96 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1078.32 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 61.26 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 90.49 | kJ/mol | Joback Calculated Property |
| log10WS | -8.19 | Crippen Calculated Property | |
| logPoct/wat | 7.771 | Crippen Calculated Property | |
| McVol | 392.080 | ml/mol | McGowan Calculated Property |
| Pc | 770.32 | kPa | Joback Calculated Property |
| Inp | [2691.00; 2691.00] |
|
|
| Inp | 2691.00 | NIST | |
| Inp | 2691.00 | NIST | |
| Tboil | 943.63 | K | Joback Calculated Property |
| Tc | 1158.72 | K | Joback Calculated Property |
| Tfus | 529.52 | K | Joback Calculated Property |
| Vc | 1.528 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1344.97; 1449.14] | J/mol×K | [943.63; 1158.72] |
|
| Cp,gas | 1344.97 | J/mol×K | 943.63 | Joback Calculated Property |
| Cp,gas | 1365.90 | J/mol×K | 979.48 | Joback Calculated Property |
| Cp,gas | 1385.32 | J/mol×K | 1015.33 | Joback Calculated Property |
| Cp,gas | 1403.28 | J/mol×K | 1051.17 | Joback Calculated Property |
| Cp,gas | 1419.86 | J/mol×K | 1087.02 | Joback Calculated Property |
| Cp,gas | 1435.13 | J/mol×K | 1122.87 | Joback Calculated Property |
| Cp,gas | 1449.14 | J/mol×K | 1158.72 | Joback Calculated Property |
| η | [0.0000166; 0.0003659] | Pa×s | [529.52; 943.63] |
|
| η | 0.0003659 | Pa×s | 529.52 | Joback Calculated Property |
| η | 0.0001622 | Pa×s | 598.54 | Joback Calculated Property |
| η | 0.0000851 | Pa×s | 667.56 | Joback Calculated Property |
| η | 0.0000504 | Pa×s | 736.58 | Joback Calculated Property |
| η | 0.0000326 | Pa×s | 805.59 | Joback Calculated Property |
| η | 0.0000226 | Pa×s | 874.61 | Joback Calculated Property |
| η | 0.0000166 | Pa×s | 943.63 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylmalonic acid, octyl tridecyl ester.
Sources
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