- InChI
- InChI=1S/C13H22O5/c1-4-5-9-17-12(15)7-6-8-13(16)18-11(3)10(2)14/h11H,4-9H2,1-3H3
- InChI Key
- BUSJEQYJLDIKCC-UHFFFAOYSA-N
- Formula
- C13H22O5
- SMILES
- CCCCOC(=O)CCCC(=O)OC(C)C(C)=O
- 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° | -540.62 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -919.11 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.08 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.20 | kJ/mol | Joback Calculated Property |
| log10WS | -2.38 | Crippen Calculated Property | |
| logPoct/wat | 2.021 | Crippen Calculated Property | |
| McVol | 210.480 | ml/mol | McGowan Calculated Property |
| Pc | 1885.44 | kPa | Joback Calculated Property |
| Inp | 1774.00 | NIST | |
| Tboil | 702.85 | K | Joback Calculated Property |
| Tc | 889.34 | K | Joback Calculated Property |
| Tfus | 415.52 | K | Joback Calculated Property |
| Vc | 0.811 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [589.85; 663.69] | J/mol×K | [702.85; 889.34] | 
|
| Cp,gas | 589.85 | J/mol×K | 702.85 | Joback Calculated Property |
| Cp,gas | 604.06 | J/mol×K | 733.93 | Joback Calculated Property |
| Cp,gas | 617.50 | J/mol×K | 765.01 | Joback Calculated Property |
| Cp,gas | 630.19 | J/mol×K | 796.10 | Joback Calculated Property |
| Cp,gas | 642.12 | J/mol×K | 827.18 | Joback Calculated Property |
| Cp,gas | 653.28 | J/mol×K | 858.26 | Joback Calculated Property |
| Cp,gas | 663.69 | J/mol×K | 889.34 | Joback Calculated Property |
| η | [0.0001236; 0.0015266] | Pa×s | [415.52; 702.85] |
|
| η | 0.0015266 | Pa×s | 415.52 | Joback Calculated Property |
| η | 0.0008087 | Pa×s | 463.41 | Joback Calculated Property |
| η | 0.0004825 | Pa×s | 511.30 | Joback Calculated Property |
| η | 0.0003145 | Pa×s | 559.18 | Joback Calculated Property |
| η | 0.0002193 | Pa×s | 607.07 | Joback Calculated Property |
| η | 0.0001612 | Pa×s | 654.96 | Joback Calculated Property |
| η | 0.0001236 | Pa×s | 702.85 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, butyl 3-oxobut-2-yl ester.
Sources
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