- InChI
- InChI=1S/C19H17Cl3O4/c20-14-11-15(21)19(16(22)12-14)26-18(24)8-4-7-17(23)25-10-9-13-5-2-1-3-6-13/h1-3,5-6,11-12H,4,7-10H2
- InChI Key
- HREXAOSKQMTJBL-UHFFFAOYSA-N
- Formula
- C19H17Cl3O4
- SMILES
-
O=C(CCCC(=O)Oc1c(Cl)cc(Cl)cc1C
l)OCCc1ccccc1 - Molecular Weight1
- 415.69
- 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° | -198.60 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -533.66 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 50.05 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 95.89 | kJ/mol | Joback Calculated Property |
| log10WS | -6.41 | Crippen Calculated Property | |
| logPoct/wat | 5.508 | Crippen Calculated Property | |
| McVol | 282.650 | ml/mol | McGowan Calculated Property |
| Pc | 1674.16 | kPa | Joback Calculated Property |
| Inp | [2947.00; 2947.00] |
|
|
| Inp | 2947.00 | NIST | |
| Inp | 2947.00 | NIST | |
| Tboil | 967.29 | K | Joback Calculated Property |
| Tc | 1204.77 | K | Joback Calculated Property |
| Tfus | 628.37 | K | Joback Calculated Property |
| Vc | 1.079 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [785.07; 825.57] | J/mol×K | [967.29; 1204.77] |
|
| Cp,gas | 785.07 | J/mol×K | 967.29 | Joback Calculated Property |
| Cp,gas | 794.84 | J/mol×K | 1006.87 | Joback Calculated Property |
| Cp,gas | 803.35 | J/mol×K | 1046.45 | Joback Calculated Property |
| Cp,gas | 810.65 | J/mol×K | 1086.03 | Joback Calculated Property |
| Cp,gas | 816.76 | J/mol×K | 1125.61 | Joback Calculated Property |
| Cp,gas | 821.73 | J/mol×K | 1165.19 | Joback Calculated Property |
| Cp,gas | 825.57 | J/mol×K | 1204.77 | Joback Calculated Property |
| η | [0.0000427; 0.0002633] | Pa×s | [628.37; 967.29] |
|
| η | 0.0002633 | Pa×s | 628.37 | Joback Calculated Property |
| η | 0.0001716 | Pa×s | 684.86 | Joback Calculated Property |
| η | 0.0001193 | Pa×s | 741.34 | Joback Calculated Property |
| η | 0.0000874 | Pa×s | 797.83 | Joback Calculated Property |
| η | 0.0000667 | Pa×s | 854.32 | Joback Calculated Property |
| η | 0.0000526 | Pa×s | 910.80 | Joback Calculated Property |
| η | 0.0000427 | Pa×s | 967.29 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 2,4,6-trichlorophenyl phenethyl ester.
Sources
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