- InChI
- InChI=1S/C15H17Cl3O4/c1-15(2,3)8-21-12(19)4-5-13(20)22-14-10(17)6-9(16)7-11(14)18/h6-7H,4-5,8H2,1-3H3
- InChI Key
- KJJILITUVBWDOM-UHFFFAOYSA-N
- Formula
- C15H17Cl3O4
- SMILES
-
CC(C)(C)COC(=O)CCC(=O)Oc1c(Cl)
cc(Cl)cc1Cl - Molecular Weight1
- 367.65
- 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° | -341.85 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -696.38 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 38.23 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 83.42 | kJ/mol | Joback Calculated Property |
| log10WS | -5.39 | Crippen Calculated Property | |
| logPoct/wat | 4.922 | Crippen Calculated Property | |
| McVol | 250.050 | ml/mol | McGowan Calculated Property |
| Pc | 1777.34 | kPa | Joback Calculated Property |
| Inp | [2271.00; 2271.00] |
|
|
| Inp | 2271.00 | NIST | |
| Inp | 2271.00 | NIST | |
| Tboil | 845.86 | K | Joback Calculated Property |
| Tc | 1069.99 | K | Joback Calculated Property |
| Tfus | 559.29 | K | Joback Calculated Property |
| Vc | 0.952 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [666.15; 720.09] | J/mol×K | [845.86; 1069.99] |
|
| Cp,gas | 666.15 | J/mol×K | 845.86 | Joback Calculated Property |
| Cp,gas | 677.55 | J/mol×K | 883.22 | Joback Calculated Property |
| Cp,gas | 687.95 | J/mol×K | 920.57 | Joback Calculated Property |
| Cp,gas | 697.38 | J/mol×K | 957.93 | Joback Calculated Property |
| Cp,gas | 705.86 | J/mol×K | 995.28 | Joback Calculated Property |
| Cp,gas | 713.42 | J/mol×K | 1032.64 | Joback Calculated Property |
| Cp,gas | 720.09 | J/mol×K | 1069.99 | Joback Calculated Property |
| η | [0.0000580; 0.0003780] | Pa×s | [559.29; 845.86] |
|
| η | 0.0003780 | Pa×s | 559.29 | Joback Calculated Property |
| η | 0.0002446 | Pa×s | 607.05 | Joback Calculated Property |
| η | 0.0001687 | Pa×s | 654.81 | Joback Calculated Property |
| η | 0.0001223 | Pa×s | 702.58 | Joback Calculated Property |
| η | 0.0000924 | Pa×s | 750.34 | Joback Calculated Property |
| η | 0.0000722 | Pa×s | 798.10 | Joback Calculated Property |
| η | 0.0000580 | Pa×s | 845.86 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 2,4,6-trichlorophenyl neopentyl ester.
Sources
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