- InChI
- InChI=1S/C14H26O5/c1-4-5-6-8-18-13(15)10-17-11-14(16)19-9-7-12(2)3/h12H,4-11H2,1-3H3
- InChI Key
- COGOLETZXYTKDA-UHFFFAOYSA-N
- Formula
- C14H26O5
- SMILES
- CCCCCOC(=O)COCC(=O)OCCC(C)C
- Molecular Weight1
- 274.35
- 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° | -508.28 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -959.39 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 35.25 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.09 | kJ/mol | Joback Calculated Property |
| log10WS | -2.25 | Crippen Calculated Property | |
| logPoct/wat | 2.326 | Crippen Calculated Property | |
| McVol | 228.870 | ml/mol | McGowan Calculated Property |
| Pc | 1627.22 | kPa | Joback Calculated Property |
| Inp | [2216.00; 2216.00] |
|
|
| Inp | 2216.00 | NIST | |
| Inp | 2216.00 | NIST | |
| Tboil | 694.28 | K | Joback Calculated Property |
| Tc | 872.83 | K | Joback Calculated Property |
| Tfus | 399.09 | K | Joback Calculated Property |
| Vc | 0.879 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [651.48; 734.04] | J/mol×K | [694.28; 872.83] |
|
| Cp,gas | 651.48 | J/mol×K | 694.28 | Joback Calculated Property |
| Cp,gas | 667.16 | J/mol×K | 724.04 | Joback Calculated Property |
| Cp,gas | 682.08 | J/mol×K | 753.80 | Joback Calculated Property |
| Cp,gas | 696.23 | J/mol×K | 783.56 | Joback Calculated Property |
| Cp,gas | 709.61 | J/mol×K | 813.32 | Joback Calculated Property |
| Cp,gas | 722.22 | J/mol×K | 843.08 | Joback Calculated Property |
| Cp,gas | 734.04 | J/mol×K | 872.83 | Joback Calculated Property |
| η | [0.0000852; 0.0012554] | Pa×s | [399.09; 694.28] |
|
| η | 0.0012554 | Pa×s | 399.09 | Joback Calculated Property |
| η | 0.0006269 | Pa×s | 448.29 | Joback Calculated Property |
| η | 0.0003592 | Pa×s | 497.49 | Joback Calculated Property |
| η | 0.0002275 | Pa×s | 546.68 | Joback Calculated Property |
| η | 0.0001553 | Pa×s | 595.88 | Joback Calculated Property |
| η | 0.0001124 | Pa×s | 645.08 | Joback Calculated Property |
| η | 0.0000852 | Pa×s | 694.28 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, 3-methylbutyl pentyl ester.
Sources
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