- InChI
- InChI=1S/C12H22O5/c1-9(2)5-16-11(13)7-15-8-12(14)17-6-10(3)4/h9-10H,5-8H2,1-4H3
- InChI Key
- OUAMATOUUTZOLD-UHFFFAOYSA-N
- Formula
- C12H22O5
- SMILES
- CC(C)COC(=O)COCC(=O)OCC(C)C
- Molecular Weight1
- 246.30
- 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° | -527.56 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -923.39 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 26.55 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 62.25 | kJ/mol | Joback Calculated Property |
| log10WS | -1.17 | Crippen Calculated Property | |
| logPoct/wat | 1.401 | Crippen Calculated Property | |
| McVol | 200.690 | ml/mol | McGowan Calculated Property |
| Pc | 1925.36 | kPa | Joback Calculated Property |
| Inp | [1915.00; 1915.00] |
|
|
| Inp | 1915.00 | NIST | |
| Inp | 1915.00 | NIST | |
| Tboil | 648.08 | K | Joback Calculated Property |
| Tc | 830.65 | K | Joback Calculated Property |
| Tfus | 361.55 | K | Joback Calculated Property |
| Vc | 0.761 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [544.21; 623.21] | J/mol×K | [648.08; 830.65] |
|
| Cp,gas | 544.21 | J/mol×K | 648.08 | Joback Calculated Property |
| Cp,gas | 559.13 | J/mol×K | 678.51 | Joback Calculated Property |
| Cp,gas | 573.35 | J/mol×K | 708.94 | Joback Calculated Property |
| Cp,gas | 586.88 | J/mol×K | 739.36 | Joback Calculated Property |
| Cp,gas | 599.71 | J/mol×K | 769.79 | Joback Calculated Property |
| Cp,gas | 611.82 | J/mol×K | 800.22 | Joback Calculated Property |
| Cp,gas | 623.21 | J/mol×K | 830.65 | Joback Calculated Property |
| η | [0.0001023; 0.0018669] | Pa×s | [361.55; 648.08] |
|
| η | 0.0018669 | Pa×s | 361.55 | Joback Calculated Property |
| η | 0.0008676 | Pa×s | 409.31 | Joback Calculated Property |
| η | 0.0004732 | Pa×s | 457.06 | Joback Calculated Property |
| η | 0.0002895 | Pa×s | 504.81 | Joback Calculated Property |
| η | 0.0001928 | Pa×s | 552.57 | Joback Calculated Property |
| η | 0.0001370 | Pa×s | 600.32 | Joback Calculated Property |
| η | 0.0001023 | Pa×s | 648.08 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, di(isobutyl) ester.
Sources
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