- InChI
- InChI=1S/C17H11Cl5O4/c18-9-4-5-14(11(20)6-9)25-15(23)2-1-3-16(24)26-17-12(21)7-10(19)8-13(17)22/h4-8H,1-3H2
- InChI Key
- IUKCCWJOFBLWIU-UHFFFAOYSA-N
- Formula
- C17H11Cl5O4
- SMILES
-
O=C(CCCC(=O)Oc1c(Cl)cc(Cl)cc1C
l)Oc1ccc(Cl)cc1Cl - Molecular Weight1
- 456.53
- 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° | -258.56 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -546.80 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 52.48 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 101.53 | kJ/mol | Joback Calculated Property |
| log10WS | -7.59 | Crippen Calculated Property | |
| logPoct/wat | 6.635 | Crippen Calculated Property | |
| McVol | 278.950 | ml/mol | McGowan Calculated Property |
| Pc | 1801.56 | kPa | Joback Calculated Property |
| Inp | [3174.00; 3174.00] |
|
|
| Inp | 3174.00 | NIST | |
| Inp | 3174.00 | NIST | |
| Tboil | 1006.35 | K | Joback Calculated Property |
| Tc | 1255.15 | K | Joback Calculated Property |
| Tfus | 690.71 | K | Joback Calculated Property |
| Vc | 1.065 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [701.63; 722.75] | J/mol×K | [1006.35; 1255.15] |
|
| Cp,gas | 701.63 | J/mol×K | 1006.35 | Joback Calculated Property |
| Cp,gas | 708.20 | J/mol×K | 1047.82 | Joback Calculated Property |
| Cp,gas | 713.54 | J/mol×K | 1089.28 | Joback Calculated Property |
| Cp,gas | 717.64 | J/mol×K | 1130.75 | Joback Calculated Property |
| Cp,gas | 720.53 | J/mol×K | 1172.22 | Joback Calculated Property |
| Cp,gas | 722.23 | J/mol×K | 1213.68 | Joback Calculated Property |
| Cp,gas | 722.75 | J/mol×K | 1255.15 | Joback Calculated Property |
| η | [0.0000432; 0.0001947] | Pa×s | [690.71; 1006.35] |
|
| η | 0.0001947 | Pa×s | 690.71 | Joback Calculated Property |
| η | 0.0001386 | Pa×s | 743.32 | Joback Calculated Property |
| η | 0.0001032 | Pa×s | 795.92 | Joback Calculated Property |
| η | 0.0000797 | Pa×s | 848.53 | Joback Calculated Property |
| η | 0.0000635 | Pa×s | 901.14 | Joback Calculated Property |
| η | 0.0000518 | Pa×s | 953.74 | Joback Calculated Property |
| η | 0.0000432 | Pa×s | 1006.35 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 2,4,6-trichlorophenyl 2,4-dichlorophenyl ester.
Sources
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