- InChI
- InChI=1S/C12H22O5/c1-3-5-6-7-8-17-12(14)10-15-9-11(13)16-4-2/h3-10H2,1-2H3
- InChI Key
- OVXSVUCTPMCRSL-UHFFFAOYSA-N
- Formula
- C12H22O5
- SMILES
- CCCCCCOC(=O)COCC(=O)OCC
- Molecular Weight1
- 246.30
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.7982 | Relay (1.0) Calculated Property | |
| ΔfG° | -675.58 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1042.42 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 36.76 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.60 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.37 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.30 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.690 | Crippen Calculated Property | |
| McVol | 200.690 | ml/mol | McGowan Calculated Property |
| Pc | 1769.87 | kPa | Joback Calculated Property |
| Inp | 2034.00 | NIST | |
| Tboil | 561.95 | K | Relay (1.0) Calculated Property |
| Tc | 726.49 | K | Relay (1.0) Calculated Property |
| Tfus | 253.91 | K | Relay (1.0) Calculated Property |
| Vc | 0.776 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [531.39; 609.95] | J/mol×K | [613.02; 785.25] | 
|
| Cp,gas | 531.39 | J/mol×K | 613.02 | Joback Calculated Property |
| Cp,gas | 546.15 | J/mol×K | 641.73 | Joback Calculated Property |
| Cp,gas | 560.25 | J/mol×K | 670.43 | Joback Calculated Property |
| Cp,gas | 573.69 | J/mol×K | 699.14 | Joback Calculated Property |
| Cp,gas | 586.46 | J/mol×K | 727.84 | Joback Calculated Property |
| Cp,gas | 598.55 | J/mol×K | 756.55 | Joback Calculated Property |
| Cp,gas | 609.95 | J/mol×K | 785.25 | Joback Calculated Property |
| η | [0.0000987; 0.0025106] | Pa×s | [331.89; 613.02] |
|
| η | 0.0025106 | Pa×s | 331.89 | Joback Calculated Property |
| η | 0.0010488 | Pa×s | 378.75 | Joback Calculated Property |
| η | 0.0005309 | Pa×s | 425.60 | Joback Calculated Property |
| η | 0.0003076 | Pa×s | 472.45 | Joback Calculated Property |
| η | 0.0001967 | Pa×s | 519.31 | Joback Calculated Property |
| η | 0.0001354 | Pa×s | 566.16 | Joback Calculated Property |
| η | 0.0000987 | Pa×s | 613.02 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, ethyl hexyl ester.
Sources
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