- InChI
- InChI=1S/C24H27Cl3O4/c1-2-3-4-5-6-7-10-13-30-23(28)18-11-8-9-12-19(18)24(29)31-16-20-21(26)14-17(25)15-22(20)27/h8-9,11-12,14-15H,2-7,10,13,16H2,1H3
- InChI Key
- MBKRMIURVPUAPY-UHFFFAOYSA-N
- Formula
- C24H27Cl3O4
- SMILES
-
CCCCCCCCCOC(=O)c1ccccc1C(=O)OC
c1c(Cl)cc(Cl)cc1Cl - Molecular Weight1
- 485.83
- 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° | -166.13 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -648.33 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 62.61 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 107.68 | kJ/mol | Joback Calculated Property |
| log10WS | -9.47 | Crippen Calculated Property | |
| logPoct/wat | 7.911 | Crippen Calculated Property | |
| McVol | 353.100 | ml/mol | McGowan Calculated Property |
| Pc | 1157.71 | kPa | Joback Calculated Property |
| Inp | [3256.00; 3256.00] |
|
|
| Inp | 3256.00 | NIST | |
| Inp | 3256.00 | NIST | |
| Tboil | 1086.67 | K | Joback Calculated Property |
| Tc | 1331.19 | K | Joback Calculated Property |
| Tfus | 697.24 | K | Joback Calculated Property |
| Vc | 1.359 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1074.42; 1112.07] | J/mol×K | [1086.67; 1331.19] |
|
| Cp,gas | 1074.42 | J/mol×K | 1086.67 | Joback Calculated Property |
| Cp,gas | 1084.30 | J/mol×K | 1127.42 | Joback Calculated Property |
| Cp,gas | 1092.67 | J/mol×K | 1168.18 | Joback Calculated Property |
| Cp,gas | 1099.58 | J/mol×K | 1208.93 | Joback Calculated Property |
| Cp,gas | 1105.09 | J/mol×K | 1249.68 | Joback Calculated Property |
| Cp,gas | 1109.23 | J/mol×K | 1290.44 | Joback Calculated Property |
| Cp,gas | 1112.07 | J/mol×K | 1331.19 | Joback Calculated Property |
| η | [0.0000206; 0.0001366] | Pa×s | [697.24; 1086.67] |
|
| η | 0.0001366 | Pa×s | 697.24 | Joback Calculated Property |
| η | 0.0000871 | Pa×s | 762.14 | Joback Calculated Property |
| η | 0.0000596 | Pa×s | 827.05 | Joback Calculated Property |
| η | 0.0000431 | Pa×s | 891.96 | Joback Calculated Property |
| η | 0.0000326 | Pa×s | 956.86 | Joback Calculated Property |
| η | 0.0000255 | Pa×s | 1021.77 | Joback Calculated Property |
| η | 0.0000206 | Pa×s | 1086.67 | Joback Calculated Property |
Similar Compounds
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Sources
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