- InChI
- InChI=1S/C13H22O5/c1-9(2)8-17-12(15)6-5-7-13(16)18-11(4)10(3)14/h9,11H,5-8H2,1-4H3
- InChI Key
- QYJTZJKDGFPZIV-UHFFFAOYSA-N
- Formula
- C13H22O5
- SMILES
-
CC(=O)C(C)OC(=O)CCCC(=O)OCC(C)
C - Molecular Weight1
- 258.31
- 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° | -543.06 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -924.39 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 29.55 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.81 | kJ/mol | Joback Calculated Property |
| log10WS | -2.14 | Crippen Calculated Property | |
| logPoct/wat | 1.877 | Crippen Calculated Property | |
| McVol | 210.480 | ml/mol | McGowan Calculated Property |
| Pc | 1898.60 | kPa | Joback Calculated Property |
| Inp | 1730.00 | NIST | |
| Tboil | 702.41 | K | Joback Calculated Property |
| Tc | 891.53 | K | Joback Calculated Property |
| Tfus | 400.52 | K | Joback Calculated Property |
| Vc | 0.805 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [590.37; 665.09] | J/mol×K | [702.41; 891.53] | 
|
| Cp,gas | 590.37 | J/mol×K | 702.41 | Joback Calculated Property |
| Cp,gas | 604.80 | J/mol×K | 733.93 | Joback Calculated Property |
| Cp,gas | 618.44 | J/mol×K | 765.45 | Joback Calculated Property |
| Cp,gas | 631.29 | J/mol×K | 796.97 | Joback Calculated Property |
| Cp,gas | 643.34 | J/mol×K | 828.49 | Joback Calculated Property |
| Cp,gas | 654.61 | J/mol×K | 860.01 | Joback Calculated Property |
| Cp,gas | 665.09 | J/mol×K | 891.53 | Joback Calculated Property |
| η | [0.0001143; 0.0018474] | Pa×s | [400.52; 702.41] |
|
| η | 0.0018474 | Pa×s | 400.52 | Joback Calculated Property |
| η | 0.0008970 | Pa×s | 450.83 | Joback Calculated Property |
| η | 0.0005035 | Pa×s | 501.15 | Joback Calculated Property |
| η | 0.0003140 | Pa×s | 551.47 | Joback Calculated Property |
| η | 0.0002120 | Pa×s | 601.78 | Joback Calculated Property |
| η | 0.0001520 | Pa×s | 652.10 | Joback Calculated Property |
| η | 0.0001143 | Pa×s | 702.41 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, isobutyl 3-oxobut-2-yl ester.
Sources
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