- InChI
- InChI=1S/C11H18O4/c1-4-9(3)15-11(13)8-6-7-10(12)14-5-2/h4,9H,1,5-8H2,2-3H3
- InChI Key
- FHPJEMVMESROQH-UHFFFAOYSA-N
- Formula
- C11H18O4
- SMILES
- C=CC(C)OC(=O)CCCC(=O)OCC
- Molecular Weight1
- 214.26
- 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° | -340.70 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -639.82 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 25.02 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 57.33 | kJ/mol | Joback Calculated Property |
| log10WS | -2.12 | Crippen Calculated Property | |
| logPoct/wat | 1.837 | Crippen Calculated Property | |
| McVol | 176.430 | ml/mol | McGowan Calculated Property |
| Pc | 2200.01 | kPa | Joback Calculated Property |
| Inp | 1360.00 | NIST | |
| Tboil | 599.90 | K | Joback Calculated Property |
| Tc | 784.60 | K | Joback Calculated Property |
| Tfus | 341.29 | K | Joback Calculated Property |
| Vc | 0.674 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [444.35; 516.88] | J/mol×K | [599.90; 784.60] | 
|
| Cp,gas | 444.35 | J/mol×K | 599.90 | Joback Calculated Property |
| Cp,gas | 457.97 | J/mol×K | 630.68 | Joback Calculated Property |
| Cp,gas | 470.98 | J/mol×K | 661.47 | Joback Calculated Property |
| Cp,gas | 483.37 | J/mol×K | 692.25 | Joback Calculated Property |
| Cp,gas | 495.15 | J/mol×K | 723.03 | Joback Calculated Property |
| Cp,gas | 506.32 | J/mol×K | 753.82 | Joback Calculated Property |
| Cp,gas | 516.88 | J/mol×K | 784.60 | Joback Calculated Property |
| η | [0.0001652; 0.0022154] | Pa×s | [341.29; 599.90] |
|
| η | 0.0022154 | Pa×s | 341.29 | Joback Calculated Property |
| η | 0.0011277 | Pa×s | 384.39 | Joback Calculated Property |
| η | 0.0006577 | Pa×s | 427.49 | Joback Calculated Property |
| η | 0.0004234 | Pa×s | 470.60 | Joback Calculated Property |
| η | 0.0002935 | Pa×s | 513.70 | Joback Calculated Property |
| η | 0.0002153 | Pa×s | 556.80 | Joback Calculated Property |
| η | 0.0001652 | Pa×s | 599.90 | Joback Calculated Property |
Similar Compounds
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Sources
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