- InChI
- InChI=1S/C9H16O5/c1-3-13-8(11)5-7(10)6-9(12)14-4-2/h7,10H,3-6H2,1-2H3
- InChI Key
- OLLQYIBTJXUEEX-UHFFFAOYSA-N
- Formula
- C9H16O5
- SMILES
- CCOC(=O)CC(O)CC(=O)OCC
- Molecular Weight1
- 204.22
- CAS
- 32328-03-3
- Other Names
-
- Diethyl- «beta»-hydroxyglutarate
- Pentanedioic acid, 3-hydroxy-, diethyl ester
- 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).
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (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° | -582.20 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -876.20 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 25.21 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 70.23 | kJ/mol | Joback Calculated Property |
| log10WS | -0.69 | Crippen Calculated Property | |
| logPoct/wat | 0.254 | Crippen Calculated Property | |
| McVol | 158.420 | ml/mol | McGowan Calculated Property |
| Pc | 2799.47 | kPa | Joback Calculated Property |
| Tboil | 649.64 | K | Joback Calculated Property |
| Tc | 827.66 | K | Joback Calculated Property |
| Tfus | 381.33 | K | Joback Calculated Property |
| Vc | 0.601 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [421.95; 479.77] | J/mol×K | [649.64; 827.66] | 
|
| Cp,gas | 421.95 | J/mol×K | 649.64 | Joback Calculated Property |
| Cp,gas | 432.85 | J/mol×K | 679.31 | Joback Calculated Property |
| Cp,gas | 443.26 | J/mol×K | 708.98 | Joback Calculated Property |
| Cp,gas | 453.15 | J/mol×K | 738.65 | Joback Calculated Property |
| Cp,gas | 462.54 | J/mol×K | 768.32 | Joback Calculated Property |
| Cp,gas | 471.41 | J/mol×K | 797.99 | Joback Calculated Property |
| Cp,gas | 479.77 | J/mol×K | 827.66 | Joback Calculated Property |
| η | [0.0000534; 0.0027887] | Pa×s | [381.33; 649.64] |
|
| η | 0.0027887 | Pa×s | 381.33 | Joback Calculated Property |
| η | 0.0010206 | Pa×s | 426.05 | Joback Calculated Property |
| η | 0.0004521 | Pa×s | 470.77 | Joback Calculated Property |
| η | 0.0002307 | Pa×s | 515.49 | Joback Calculated Property |
| η | 0.0001310 | Pa×s | 560.20 | Joback Calculated Property |
| η | 0.0000809 | Pa×s | 604.92 | Joback Calculated Property |
| η | 0.0000534 | Pa×s | 649.64 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 429.70 | K | 3.10 | NIST |
Similar Compounds
Find more compounds similar to Diethyl 3-hydroxyglutarate.
Sources
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