- InChI
- InChI=1S/C14H26O3/c1-12(9-10-16-2)11-17-14(15)8-7-13-5-3-4-6-13/h12-13H,3-11H2,1-2H3
- InChI Key
- QBAANVKOMZFPGW-UHFFFAOYSA-N
- Formula
- C14H26O3
- SMILES
- COCCC(C)COC(=O)CCC1CCCC1
- Molecular Weight1
- 242.35
- 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° | -237.81 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -654.11 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 26.40 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.19 | kJ/mol | Joback Calculated Property |
| log10WS | -3.04 | Crippen Calculated Property | |
| logPoct/wat | 3.173 | Crippen Calculated Property | |
| McVol | 210.570 | ml/mol | McGowan Calculated Property |
| Pc | 1818.50 | kPa | Joback Calculated Property |
| Inp | 1755.00 | NIST | |
| Tboil | 633.27 | K | Joback Calculated Property |
| Tc | 823.95 | K | Joback Calculated Property |
| Tfus | 337.83 | K | Joback Calculated Property |
| Vc | 0.796 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [587.91; 687.76] | J/mol×K | [633.27; 823.95] | 
|
| Cp,gas | 587.91 | J/mol×K | 633.27 | Joback Calculated Property |
| Cp,gas | 606.91 | J/mol×K | 665.05 | Joback Calculated Property |
| Cp,gas | 624.95 | J/mol×K | 696.83 | Joback Calculated Property |
| Cp,gas | 642.04 | J/mol×K | 728.61 | Joback Calculated Property |
| Cp,gas | 658.19 | J/mol×K | 760.39 | Joback Calculated Property |
| Cp,gas | 673.43 | J/mol×K | 792.17 | Joback Calculated Property |
| Cp,gas | 687.76 | J/mol×K | 823.95 | Joback Calculated Property |
| η | [0.0001576; 0.0027399] | Pa×s | [337.83; 633.27] |
|
| η | 0.0027399 | Pa×s | 337.83 | Joback Calculated Property |
| η | 0.0012577 | Pa×s | 387.07 | Joback Calculated Property |
| η | 0.0006883 | Pa×s | 436.31 | Joback Calculated Property |
| η | 0.0004256 | Pa×s | 485.55 | Joback Calculated Property |
| η | 0.0002876 | Pa×s | 534.79 | Joback Calculated Property |
| η | 0.0002076 | Pa×s | 584.03 | Joback Calculated Property |
| η | 0.0001576 | Pa×s | 633.27 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Cyclopentylpropionic acid, 4-methoxy-2-methylbutyl ester.
Sources
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