- InChI
- InChI=1S/C11H13ClO2/c1-11(2,3)10(13)14-9-6-4-8(12)5-7-9/h4-7H,1-3H3
- InChI Key
- OYQBAUOEQCWQJN-UHFFFAOYSA-N
- Formula
- C11H13ClO2
- SMILES
- CC(C)(C)C(=O)Oc1ccc(Cl)cc1
- Molecular Weight1
- 212.67
- 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° | -98.49 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -314.60 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.47 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.26 | kJ/mol | Joback Calculated Property |
| log10WS | -3.48 | Crippen Calculated Property | |
| logPoct/wat | 3.291 | Crippen Calculated Property | |
| McVol | 161.770 | ml/mol | McGowan Calculated Property |
| Pc | 2684.64 | kPa | Joback Calculated Property |
| Inp | 1379.00 | NIST | |
| Tboil | 593.23 | K | Joback Calculated Property |
| Tc | 820.88 | K | Joback Calculated Property |
| Tfus | 357.17 | K | Joback Calculated Property |
| Vc | 0.606 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [376.31; 446.75] | J/mol×K | [593.23; 820.88] | 
|
| Cp,gas | 376.31 | J/mol×K | 593.23 | Joback Calculated Property |
| Cp,gas | 390.36 | J/mol×K | 631.17 | Joback Calculated Property |
| Cp,gas | 403.42 | J/mol×K | 669.11 | Joback Calculated Property |
| Cp,gas | 415.54 | J/mol×K | 707.05 | Joback Calculated Property |
| Cp,gas | 426.78 | J/mol×K | 744.99 | Joback Calculated Property |
| Cp,gas | 437.16 | J/mol×K | 782.93 | Joback Calculated Property |
| Cp,gas | 446.75 | J/mol×K | 820.88 | Joback Calculated Property |
| η | [0.0001713; 0.0017948] | Pa×s | [357.17; 593.23] |
|
| η | 0.0017948 | Pa×s | 357.17 | Joback Calculated Property |
| η | 0.0009991 | Pa×s | 396.51 | Joback Calculated Property |
| η | 0.0006182 | Pa×s | 435.86 | Joback Calculated Property |
| η | 0.0004142 | Pa×s | 475.20 | Joback Calculated Property |
| η | 0.0002950 | Pa×s | 514.54 | Joback Calculated Property |
| η | 0.0002205 | Pa×s | 553.89 | Joback Calculated Property |
| η | 0.0001713 | Pa×s | 593.23 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,2-Dimethylpropanoic acid, 4-chlorophenyl ester.
Sources
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