- InChI
- InChI=1S/C11H14O2/c1-3-9-4-6-10(7-5-9)8(2)11(12)13/h4-8H,3H2,1-2H3,(H,12,13)
- InChI Key
- VGMCZELQCNPMQV-UHFFFAOYSA-N
- Formula
- C11H14O2
- SMILES
- CCc1ccc(C(C)C(=O)O)cc1
- Molecular Weight1
- 178.23
- Other Names
-
- 2-(4-Ethylphenyl)propanoic acid
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.6775 | Relay (1.0) Calculated Property | |
| ΔfG° | -201.83 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -411.62 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 24.52 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.10 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.71 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.48 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.437 | Crippen Calculated Property | |
| McVol | 149.530 | ml/mol | McGowan Calculated Property |
| Pc | 2887.40 | kPa | Joback Calculated Property |
| Inp | [1473.00; 1473.00] |
|
|
| Inp | 1473.00 | NIST | |
| Inp | 1473.00 | NIST | |
| Tboil | 550.79 | K | Relay (1.0) Calculated Property |
| Tc | 776.27 | K | Relay (1.0) Calculated Property |
| Tfus | 316.40 | K | Relay (1.0) Calculated Property |
| Vc | 0.536 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [377.80; 444.90] | J/mol×K | [628.01; 849.53] |
|
| Cp,gas | 377.80 | J/mol×K | 628.01 | Joback Calculated Property |
| Cp,gas | 391.02 | J/mol×K | 664.93 | Joback Calculated Property |
| Cp,gas | 403.36 | J/mol×K | 701.85 | Joback Calculated Property |
| Cp,gas | 414.87 | J/mol×K | 738.77 | Joback Calculated Property |
| Cp,gas | 425.61 | J/mol×K | 775.69 | Joback Calculated Property |
| Cp,gas | 435.60 | J/mol×K | 812.61 | Joback Calculated Property |
| Cp,gas | 444.90 | J/mol×K | 849.53 | Joback Calculated Property |
| η | [0.0001785; 0.0012685] | Pa×s | [398.27; 628.01] |
|
| η | 0.0012685 | Pa×s | 398.27 | Joback Calculated Property |
| η | 0.0007926 | Pa×s | 436.56 | Joback Calculated Property |
| η | 0.0005343 | Pa×s | 474.85 | Joback Calculated Property |
| η | 0.0003820 | Pa×s | 513.14 | Joback Calculated Property |
| η | 0.0002862 | Pa×s | 551.43 | Joback Calculated Property |
| η | 0.0002226 | Pa×s | 589.72 | Joback Calculated Property |
| η | 0.0001785 | Pa×s | 628.01 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propanoic acid, 2-(4-ethylphenyl).
Sources
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