- InChI
- InChI=1S/C10H12O3/c1-10(7-11,9(12)13)8-5-3-2-4-6-8/h2-6,11H,7H2,1H3,(H,12,13)
- InChI Key
- ISSYFABJJSOCQG-UHFFFAOYSA-N
- Formula
- C10H12O3
- SMILES
- CC(CO)(C(=O)O)c1ccccc1
- Molecular Weight1
- 180.20
- CAS
- 4370-81-4
- 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° | -253.99 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -438.99 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 18.06 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.94 | kJ/mol | Joback Calculated Property |
| log10WS | -1.15 | Crippen Calculated Property | |
| logPoct/wat | 1.021 | Crippen Calculated Property | |
| McVol | 141.310 | ml/mol | McGowan Calculated Property |
| Pc | 4000.70 | kPa | Joback Calculated Property |
| Tboil | 689.88 | K | Joback Calculated Property |
| Tc | 888.69 | K | Joback Calculated Property |
| Tfus | 402.87 | K | Joback Calculated Property |
| Vc | 0.520 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [377.94; 425.26] | J/mol×K | [689.88; 888.69] | 
|
| Cp,gas | 377.94 | J/mol×K | 689.88 | Joback Calculated Property |
| Cp,gas | 387.30 | J/mol×K | 723.02 | Joback Calculated Property |
| Cp,gas | 396.01 | J/mol×K | 756.15 | Joback Calculated Property |
| Cp,gas | 404.12 | J/mol×K | 789.29 | Joback Calculated Property |
| Cp,gas | 411.66 | J/mol×K | 822.42 | Joback Calculated Property |
| Cp,gas | 418.69 | J/mol×K | 855.56 | Joback Calculated Property |
| Cp,gas | 425.26 | J/mol×K | 888.69 | Joback Calculated Property |
| η | [0.0000147; 0.0031978] | Pa×s | [402.87; 689.88] |
|
| η | 0.0031978 | Pa×s | 402.87 | Joback Calculated Property |
| η | 0.0008102 | Pa×s | 450.70 | Joback Calculated Property |
| η | 0.0002672 | Pa×s | 498.54 | Joback Calculated Property |
| η | 0.0001070 | Pa×s | 546.38 | Joback Calculated Property |
| η | 0.0000496 | Pa×s | 594.21 | Joback Calculated Property |
| η | 0.0000258 | Pa×s | 642.05 | Joback Calculated Property |
| η | 0.0000147 | Pa×s | 689.88 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Methyl-2-phenyl-3-hydroxypropanoic acid.
Sources
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