- InChI
- InChI=1S/C13H13Cl3O4/c1-4-19-11(17)13(2,3)12(18)20-10-8(15)5-7(14)6-9(10)16/h5-6H,4H2,1-3H3
- InChI Key
- VMYHHAPFJCPJOM-UHFFFAOYSA-N
- Formula
- C13H13Cl3O4
- SMILES
-
CCOC(=O)C(C)(C)C(=O)Oc1c(Cl)cc
(Cl)cc1Cl - Molecular Weight1
- 339.60
- 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° | -358.69 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -655.10 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.05 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.97 | kJ/mol | Joback Calculated Property |
| log10WS | -4.55 | Crippen Calculated Property | |
| logPoct/wat | 4.141 | Crippen Calculated Property | |
| McVol | 221.870 | ml/mol | McGowan Calculated Property |
| Pc | 2104.20 | kPa | Joback Calculated Property |
| Inp | 1998.00 | NIST | |
| Tboil | 800.10 | K | Joback Calculated Property |
| Tc | 1029.93 | K | Joback Calculated Property |
| Tfus | 536.75 | K | Joback Calculated Property |
| Vc | 0.840 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [558.03; 608.44] | J/mol×K | [800.10; 1029.93] | 
|
| Cp,gas | 558.03 | J/mol×K | 800.10 | Joback Calculated Property |
| Cp,gas | 568.73 | J/mol×K | 838.41 | Joback Calculated Property |
| Cp,gas | 578.47 | J/mol×K | 876.71 | Joback Calculated Property |
| Cp,gas | 587.29 | J/mol×K | 915.02 | Joback Calculated Property |
| Cp,gas | 595.22 | J/mol×K | 953.32 | Joback Calculated Property |
| Cp,gas | 602.26 | J/mol×K | 991.63 | Joback Calculated Property |
| Cp,gas | 608.44 | J/mol×K | 1029.93 | Joback Calculated Property |
| η | [0.0000777; 0.0004617] | Pa×s | [536.75; 800.10] |
|
| η | 0.0004617 | Pa×s | 536.75 | Joback Calculated Property |
| η | 0.0003067 | Pa×s | 580.64 | Joback Calculated Property |
| η | 0.0002157 | Pa×s | 624.53 | Joback Calculated Property |
| η | 0.0001590 | Pa×s | 668.42 | Joback Calculated Property |
| η | 0.0001216 | Pa×s | 712.32 | Joback Calculated Property |
| η | 0.0000960 | Pa×s | 756.21 | Joback Calculated Property |
| η | 0.0000777 | Pa×s | 800.10 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylmalonic acid, ethyl 2,4,6-trichlorophenyl ester.
Sources
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