- InChI
- InChI=1S/C12H12Cl4O3/c1-7(19-11(17)12(2,15)16)6-18-8-3-4-9(13)10(14)5-8/h3-5,7H,6H2,1-2H3
- InChI Key
- KGLPCYVCDGKBJA-UHFFFAOYSA-N
- Formula
- C12H12Cl4O3
- SMILES
-
CC(COc1ccc(Cl)c(Cl)c1)OC(=O)C(
C)(Cl)Cl - Molecular Weight1
- 346.03
- CAS
- 116402-60-9
- 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° | -242.93 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -531.43 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 29.93 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.33 | kJ/mol | Joback Calculated Property |
| log10WS | -4.94 | Crippen Calculated Property | |
| logPoct/wat | 4.498 | Crippen Calculated Property | |
| McVol | 218.450 | ml/mol | McGowan Calculated Property |
| Pc | 2141.36 | kPa | Joback Calculated Property |
| Tboil | 755.36 | K | Joback Calculated Property |
| Tc | 989.53 | K | Joback Calculated Property |
| Tfus | 477.95 | K | Joback Calculated Property |
| Vc | 0.821 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [520.51; 573.27] | J/mol×K | [755.36; 989.53] | 
|
| Cp,gas | 520.51 | J/mol×K | 755.36 | Joback Calculated Property |
| Cp,gas | 531.57 | J/mol×K | 794.39 | Joback Calculated Property |
| Cp,gas | 541.68 | J/mol×K | 833.42 | Joback Calculated Property |
| Cp,gas | 550.87 | J/mol×K | 872.44 | Joback Calculated Property |
| Cp,gas | 559.18 | J/mol×K | 911.47 | Joback Calculated Property |
| Cp,gas | 566.64 | J/mol×K | 950.50 | Joback Calculated Property |
| Cp,gas | 573.27 | J/mol×K | 989.53 | Joback Calculated Property |
| η | [0.0000744; 0.0006522] | Pa×s | [477.95; 755.36] |
|
| η | 0.0006522 | Pa×s | 477.95 | Joback Calculated Property |
| η | 0.0003872 | Pa×s | 524.18 | Joback Calculated Property |
| η | 0.0002501 | Pa×s | 570.42 | Joback Calculated Property |
| η | 0.0001725 | Pa×s | 616.65 | Joback Calculated Property |
| η | 0.0001253 | Pa×s | 662.89 | Joback Calculated Property |
| η | 0.0000949 | Pa×s | 709.12 | Joback Calculated Property |
| η | 0.0000744 | Pa×s | 755.36 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-(3,4-Dichlorophenoxy)-1-methylethyl 2,2-dichloropropanoate.
Sources
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