- InChI
- InChI=1S/C20H38O5/c1-15(9-19(3,4)5)11-24-17(21)13-23-14-18(22)25-12-16(2)10-20(6,7)8/h15-16H,9-14H2,1-8H3
- InChI Key
- BGSIVQJXQZWKLE-UHFFFAOYSA-N
- Formula
- C20H38O5
- SMILES
-
CC(COC(=O)COCC(=O)OCC(C)CC(C)(
C)C)CC(C)(C)C - Molecular Weight1
- 358.51
- 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° | -454.52 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1106.01 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 32.44 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.47 | kJ/mol | Joback Calculated Property |
| log10WS | -4.04 | Crippen Calculated Property | |
| logPoct/wat | 4.234 | Crippen Calculated Property | |
| McVol | 313.410 | ml/mol | McGowan Calculated Property |
| Pc | 1104.47 | kPa | Joback Calculated Property |
| Inp | [2628.00; 2628.00] |
|
|
| Inp | 2628.00 | NIST | |
| Inp | 2628.00 | NIST | |
| Tboil | 824.66 | K | Joback Calculated Property |
| Tc | 1018.35 | K | Joback Calculated Property |
| Tfus | 456.55 | K | Joback Calculated Property |
| Vc | 1.188 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1003.50; 1095.79] | J/mol×K | [824.66; 1018.35] |
|
| Cp,gas | 1003.50 | J/mol×K | 824.66 | Joback Calculated Property |
| Cp,gas | 1021.69 | J/mol×K | 856.94 | Joback Calculated Property |
| Cp,gas | 1038.71 | J/mol×K | 889.22 | Joback Calculated Property |
| Cp,gas | 1054.59 | J/mol×K | 921.50 | Joback Calculated Property |
| Cp,gas | 1069.37 | J/mol×K | 953.79 | Joback Calculated Property |
| Cp,gas | 1083.09 | J/mol×K | 986.07 | Joback Calculated Property |
| Cp,gas | 1095.79 | J/mol×K | 1018.35 | Joback Calculated Property |
| η | [0.0000212; 0.0007238] | Pa×s | [456.55; 824.66] |
|
| η | 0.0007238 | Pa×s | 456.55 | Joback Calculated Property |
| η | 0.0002837 | Pa×s | 517.90 | Joback Calculated Property |
| η | 0.0001356 | Pa×s | 579.25 | Joback Calculated Property |
| η | 0.0000747 | Pa×s | 640.61 | Joback Calculated Property |
| η | 0.0000456 | Pa×s | 701.96 | Joback Calculated Property |
| η | 0.0000302 | Pa×s | 763.31 | Joback Calculated Property |
| η | 0.0000212 | Pa×s | 824.66 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, di(2,4,4-trimethylpentyl) ester.
Sources
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