- InChI
- InChI=1S/C15H14O2/c1-15(14(16)17,12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11H,1H3,(H,16,17)
- InChI Key
- ODELFXJUOVNEFZ-UHFFFAOYSA-N
- Formula
- C15H14O2
- SMILES
- CC(C(=O)O)(c1ccccc1)c1ccccc1
- Molecular Weight1
- 226.27
- CAS
- 5558-66-7
- Other Names
-
- «alpha»,«alpha»-Diphenylpropionic acid
- Benzeneacetic acid, «alpha»-methyl-«alpha»-phenyl-
- 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).
- 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° | 37.34 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -153.43 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.67 | kJ/mol | Joback Calculated Property |
| log10WS | -3.18 | Crippen Calculated Property | |
| logPoct/wat | 3.077 | Crippen Calculated Property | |
| McVol | 182.130 | ml/mol | McGowan Calculated Property |
| Pc | 3012.33 | kPa | Joback Calculated Property |
| Tboil | 738.78 | K | Joback Calculated Property |
| Tc | 972.48 | K | Joback Calculated Property |
| Tfus | 424.82 | K | Joback Calculated Property |
| Vc | 0.673 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [496.73; 559.68] | J/mol×K | [738.78; 972.48] | 
|
| Cp,gas | 496.73 | J/mol×K | 738.78 | Joback Calculated Property |
| Cp,gas | 509.60 | J/mol×K | 777.73 | Joback Calculated Property |
| Cp,gas | 521.38 | J/mol×K | 816.68 | Joback Calculated Property |
| Cp,gas | 532.18 | J/mol×K | 855.63 | Joback Calculated Property |
| Cp,gas | 542.09 | J/mol×K | 894.58 | Joback Calculated Property |
| Cp,gas | 551.22 | J/mol×K | 933.53 | Joback Calculated Property |
| Cp,gas | 559.68 | J/mol×K | 972.48 | Joback Calculated Property |
| η | [0.0000309; 0.0016801] | Pa×s | [424.82; 738.78] |
|
| η | 0.0016801 | Pa×s | 424.82 | Joback Calculated Property |
| η | 0.0005989 | Pa×s | 477.15 | Joback Calculated Property |
| η | 0.0002617 | Pa×s | 529.47 | Joback Calculated Property |
| η | 0.0001328 | Pa×s | 581.80 | Joback Calculated Property |
| η | 0.0000753 | Pa×s | 634.13 | Joback Calculated Property |
| η | 0.0000466 | Pa×s | 686.45 | Joback Calculated Property |
| η | 0.0000309 | Pa×s | 738.78 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,2-Diphenylpropionic acid.
Sources
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