- InChI
- InChI=1S/C11H13ClO4/c1-4-16-11(14)9-6(2)10(12)8(15-3)5-7(9)13/h5,13H,4H2,1-3H3
- InChI Key
- DTAMIZHNUNMPJD-UHFFFAOYSA-N
- Formula
- C11H13ClO4
- SMILES
- CCOC(=O)c1c(O)cc(OC)c(Cl)c1C
- Molecular Weight1
- 244.67
- CAS
- 57074-24-5
- 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° | -380.21 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -638.32 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 31.07 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.31 | kJ/mol | Joback Calculated Property |
| log10WS | -2.96 | Crippen Calculated Property | |
| logPoct/wat | 2.539 | Crippen Calculated Property | |
| McVol | 173.510 | ml/mol | McGowan Calculated Property |
| Pc | 2931.34 | kPa | Joback Calculated Property |
| Inp | [1874.70; 1874.70] |
|
|
| Inp | 1874.70 | NIST | |
| Inp | 1874.70 | NIST | |
| Tboil | 709.46 | K | Joback Calculated Property |
| Tc | 931.85 | K | Joback Calculated Property |
| Tfus | 513.74 | K | Joback Calculated Property |
| Vc | 0.601 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [442.40; 501.57] | J/mol×K | [709.46; 931.85] |
|
| Cp,gas | 442.40 | J/mol×K | 709.46 | Joback Calculated Property |
| Cp,gas | 453.75 | J/mol×K | 746.52 | Joback Calculated Property |
| Cp,gas | 464.46 | J/mol×K | 783.59 | Joback Calculated Property |
| Cp,gas | 474.57 | J/mol×K | 820.65 | Joback Calculated Property |
| Cp,gas | 484.11 | J/mol×K | 857.72 | Joback Calculated Property |
| Cp,gas | 493.10 | J/mol×K | 894.78 | Joback Calculated Property |
| Cp,gas | 501.57 | J/mol×K | 931.85 | Joback Calculated Property |
| η | [0.0000130; 0.0001385] | Pa×s | [513.74; 709.46] |
|
| η | 0.0001385 | Pa×s | 513.74 | Joback Calculated Property |
| η | 0.0000830 | Pa×s | 546.36 | Joback Calculated Property |
| η | 0.0000527 | Pa×s | 578.98 | Joback Calculated Property |
| η | 0.0000352 | Pa×s | 611.60 | Joback Calculated Property |
| η | 0.0000244 | Pa×s | 644.22 | Joback Calculated Property |
| η | 0.0000176 | Pa×s | 676.84 | Joback Calculated Property |
| η | 0.0000130 | Pa×s | 709.46 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Ethyl 3-chloro-6-hydroxy-4-methoxy-2-methylbenzoate.
Sources
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