- InChI
- InChI=1S/C11H12O3/c1-8(11(13)14-2)10-5-3-9(7-12)4-6-10/h3-8H,1-2H3
- InChI Key
- RBAQUIFHFPBFJL-UHFFFAOYSA-N
- Formula
- C11H12O3
- SMILES
- COC(=O)C(C)c1ccc(C=O)cc1
- Molecular Weight1
- 192.21
- 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° | -191.36 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -380.97 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 19.45 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.51 | kJ/mol | Joback Calculated Property |
| log10WS | -2.18 | Crippen Calculated Property | |
| logPoct/wat | 1.776 | Crippen Calculated Property | |
| McVol | 151.100 | ml/mol | McGowan Calculated Property |
| Pc | 2986.06 | kPa | Joback Calculated Property |
| Inp | 1478.00 | NIST | |
| Tboil | 607.25 | K | Joback Calculated Property |
| Tc | 824.77 | K | Joback Calculated Property |
| Tfus | 351.83 | K | Joback Calculated Property |
| Vc | 0.579 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [364.06; 429.92] | J/mol×K | [607.25; 824.77] | 
|
| Cp,gas | 364.06 | J/mol×K | 607.25 | Joback Calculated Property |
| Cp,gas | 376.97 | J/mol×K | 643.50 | Joback Calculated Property |
| Cp,gas | 389.08 | J/mol×K | 679.76 | Joback Calculated Property |
| Cp,gas | 400.42 | J/mol×K | 716.01 | Joback Calculated Property |
| Cp,gas | 410.99 | J/mol×K | 752.26 | Joback Calculated Property |
| Cp,gas | 420.82 | J/mol×K | 788.52 | Joback Calculated Property |
| Cp,gas | 429.92 | J/mol×K | 824.77 | Joback Calculated Property |
| η | [0.0002131; 0.0021334] | Pa×s | [351.83; 607.25] |
|
| η | 0.0021334 | Pa×s | 351.83 | Joback Calculated Property |
| η | 0.0011812 | Pa×s | 394.40 | Joback Calculated Property |
| η | 0.0007338 | Pa×s | 436.97 | Joback Calculated Property |
| η | 0.0004961 | Pa×s | 479.54 | Joback Calculated Property |
| η | 0.0003575 | Pa×s | 522.11 | Joback Calculated Property |
| η | 0.0002707 | Pa×s | 564.68 | Joback Calculated Property |
| η | 0.0002131 | Pa×s | 607.25 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-(4-Formylphenyl)propanoic acid, methyl.
Sources
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