- InChI
- InChI=1S/C14H15Cl3O4/c1-2-6-20-12(18)4-3-5-13(19)21-9-7-10(15)14(17)11(16)8-9/h7-8H,2-6H2,1H3
- InChI Key
- UDYZWAASVIUOKU-UHFFFAOYSA-N
- Formula
- C14H15Cl3O4
- SMILES
-
CCCOC(=O)CCCC(=O)Oc1cc(Cl)c(Cl
)c(Cl)c1 - Molecular Weight1
- 353.62
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.8492 | Relay (1.0) Calculated Property | |
| ΔfG° | -353.11 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -793.21 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 43.05 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 95.60 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.75 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.41 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.676 | Crippen Calculated Property | |
| McVol | 235.960 | ml/mol | McGowan Calculated Property |
| Pc | 1898.60 | kPa | Joback Calculated Property |
| Inp | 2449.00 | NIST | |
| Tboil | 626.26 | K | Relay (1.0) Calculated Property |
| Tc | 857.70 | K | Relay (1.0) Calculated Property |
| Tfus | 324.18 | K | Relay (1.0) Calculated Property |
| Vc | 0.864 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [609.81; 661.54] | J/mol×K | [826.21; 1043.90] | 
|
| Cp,gas | 609.81 | J/mol×K | 826.21 | Joback Calculated Property |
| Cp,gas | 620.76 | J/mol×K | 862.49 | Joback Calculated Property |
| Cp,gas | 630.78 | J/mol×K | 898.77 | Joback Calculated Property |
| Cp,gas | 639.87 | J/mol×K | 935.06 | Joback Calculated Property |
| Cp,gas | 648.02 | J/mol×K | 971.34 | Joback Calculated Property |
| Cp,gas | 655.24 | J/mol×K | 1007.62 | Joback Calculated Property |
| Cp,gas | 661.54 | J/mol×K | 1043.90 | Joback Calculated Property |
| η | [0.0000845; 0.0004707] | Pa×s | [545.60; 826.21] |
|
| η | 0.0004707 | Pa×s | 545.60 | Joback Calculated Property |
| η | 0.0003158 | Pa×s | 592.37 | Joback Calculated Property |
| η | 0.0002246 | Pa×s | 639.14 | Joback Calculated Property |
| η | 0.0001673 | Pa×s | 685.90 | Joback Calculated Property |
| η | 0.0001294 | Pa×s | 732.67 | Joback Calculated Property |
| η | 0.0001033 | Pa×s | 779.44 | Joback Calculated Property |
| η | 0.0000845 | Pa×s | 826.21 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, propyl 3,4,5-trichlorophenyl ester.
Sources
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