- InChI
- InChI=1S/C10H12O3/c1-7-5-8(6-10(11)12)3-4-9(7)13-2/h3-5H,6H2,1-2H3,(H,11,12)
- InChI Key
- GYBWDAKGSPTODN-UHFFFAOYSA-N
- Formula
- C10H12O3
- SMILES
- COc1ccc(CC(=O)O)cc1C
- Molecular Weight1
- 180.20
- CAS
- 4513-73-9
- 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° | -244.27 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -433.17 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 21.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.29 | kJ/mol | Joback Calculated Property |
| log10WS | -1.97 | Crippen Calculated Property | |
| logPoct/wat | 1.631 | Crippen Calculated Property | |
| McVol | 141.310 | ml/mol | McGowan Calculated Property |
| Pc | 3306.75 | kPa | Joback Calculated Property |
| Tboil | 633.31 | K | Joback Calculated Property |
| Tc | 833.65 | K | Joback Calculated Property |
| Tfus | 386.90 | K | Joback Calculated Property |
| Vc | 0.530 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [349.09; 405.20] | J/mol×K | [633.31; 833.65] | 
|
| Cp,gas | 349.09 | J/mol×K | 633.31 | Joback Calculated Property |
| Cp,gas | 359.86 | J/mol×K | 666.70 | Joback Calculated Property |
| Cp,gas | 370.06 | J/mol×K | 700.09 | Joback Calculated Property |
| Cp,gas | 379.69 | J/mol×K | 733.48 | Joback Calculated Property |
| Cp,gas | 388.75 | J/mol×K | 766.87 | Joback Calculated Property |
| Cp,gas | 397.25 | J/mol×K | 800.26 | Joback Calculated Property |
| Cp,gas | 405.20 | J/mol×K | 833.65 | Joback Calculated Property |
| η | [0.0000649; 0.0017397] | Pa×s | [386.90; 633.31] |
|
| η | 0.0017397 | Pa×s | 386.90 | Joback Calculated Property |
| η | 0.0007730 | Pa×s | 427.97 | Joback Calculated Property |
| η | 0.0003959 | Pa×s | 469.04 | Joback Calculated Property |
| η | 0.0002258 | Pa×s | 510.10 | Joback Calculated Property |
| η | 0.0001400 | Pa×s | 551.17 | Joback Calculated Property |
| η | 0.0000928 | Pa×s | 592.24 | Joback Calculated Property |
| η | 0.0000649 | Pa×s | 633.31 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Methoxy-3-methylphenylacetic acid.
Sources
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