- InChI
- InChI=1S/C18H23Cl3O4/c1-2-24-17(22)9-7-5-3-4-6-8-10-18(23)25-16-12-14(20)13(19)11-15(16)21/h11-12H,2-10H2,1H3
- InChI Key
- QWEPISMWDIWANA-UHFFFAOYSA-N
- Formula
- C18H23Cl3O4
- SMILES
-
CCOC(=O)CCCCCCCCC(=O)Oc1cc(Cl)
c(Cl)cc1Cl - Molecular Weight1
- 409.73
- 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° | -319.43 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -749.55 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 53.41 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.39 | kJ/mol | Joback Calculated Property |
| log10WS | -6.89 | Crippen Calculated Property | |
| logPoct/wat | 6.236 | Crippen Calculated Property | |
| McVol | 292.320 | ml/mol | McGowan Calculated Property |
| Pc | 1393.33 | kPa | Joback Calculated Property |
| Inp | [2801.00; 2801.00] |
|
|
| Inp | 2801.00 | NIST | |
| Inp | 2801.00 | NIST | |
| Tboil | 917.73 | K | Joback Calculated Property |
| Tc | 1133.26 | K | Joback Calculated Property |
| Tfus | 590.68 | K | Joback Calculated Property |
| Vc | 1.131 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [834.27; 889.90] | J/mol×K | [917.73; 1133.26] |
|
| Cp,gas | 834.27 | J/mol×K | 917.73 | Joback Calculated Property |
| Cp,gas | 846.30 | J/mol×K | 953.65 | Joback Calculated Property |
| Cp,gas | 857.21 | J/mol×K | 989.57 | Joback Calculated Property |
| Cp,gas | 867.01 | J/mol×K | 1025.49 | Joback Calculated Property |
| Cp,gas | 875.72 | J/mol×K | 1061.41 | Joback Calculated Property |
| Cp,gas | 883.34 | J/mol×K | 1097.33 | Joback Calculated Property |
| Cp,gas | 889.90 | J/mol×K | 1133.26 | Joback Calculated Property |
| η | [0.0000477; 0.0003165] | Pa×s | [590.68; 917.73] |
|
| η | 0.0003165 | Pa×s | 590.68 | Joback Calculated Property |
| η | 0.0002021 | Pa×s | 645.19 | Joback Calculated Property |
| η | 0.0001384 | Pa×s | 699.70 | Joback Calculated Property |
| η | 0.0001001 | Pa×s | 754.21 | Joback Calculated Property |
| η | 0.0000757 | Pa×s | 808.71 | Joback Calculated Property |
| η | 0.0000592 | Pa×s | 863.22 | Joback Calculated Property |
| η | 0.0000477 | Pa×s | 917.73 | Joback Calculated Property |
Similar Compounds
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Sources
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