- InChI
- InChI=1S/C18H31Cl3O4/c1-2-3-4-11-14-24-16(22)12-9-7-5-6-8-10-13-17(23)25-15-18(19,20)21/h2-15H2,1H3
- InChI Key
- PDWZXDNMAHLCCS-UHFFFAOYSA-N
- Formula
- C18H31Cl3O4
- SMILES
-
CCCCCCOC(=O)CCCCCCCCC(=O)OCC(C
l)(Cl)Cl - Molecular Weight1
- 417.80
- 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° | -400.11 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -960.42 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 53.13 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 85.83 | kJ/mol | Joback Calculated Property |
| log10WS | -6.64 | Crippen Calculated Property | |
| logPoct/wat | 6.144 | Crippen Calculated Property | |
| McVol | 316.080 | ml/mol | McGowan Calculated Property |
| Pc | 1152.22 | kPa | Joback Calculated Property |
| Inp | [2620.00; 2620.00] |
|
|
| Inp | 2620.00 | NIST | |
| Inp | 2620.00 | NIST | |
| Tboil | 872.88 | K | Joback Calculated Property |
| Tc | 1072.77 | K | Joback Calculated Property |
| Tfus | 529.12 | K | Joback Calculated Property |
| Vc | 1.228 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [938.85; 1012.11] | J/mol×K | [872.88; 1072.77] |
|
| Cp,gas | 938.85 | J/mol×K | 872.88 | Joback Calculated Property |
| Cp,gas | 953.46 | J/mol×K | 906.19 | Joback Calculated Property |
| Cp,gas | 967.05 | J/mol×K | 939.51 | Joback Calculated Property |
| Cp,gas | 979.68 | J/mol×K | 972.82 | Joback Calculated Property |
| Cp,gas | 991.37 | J/mol×K | 1006.14 | Joback Calculated Property |
| Cp,gas | 1002.17 | J/mol×K | 1039.45 | Joback Calculated Property |
| Cp,gas | 1012.11 | J/mol×K | 1072.77 | Joback Calculated Property |
| η | [0.0000345; 0.0004661] | Pa×s | [529.12; 872.88] |
|
| η | 0.0004661 | Pa×s | 529.12 | Joback Calculated Property |
| η | 0.0002444 | Pa×s | 586.41 | Joback Calculated Property |
| η | 0.0001438 | Pa×s | 643.71 | Joback Calculated Property |
| η | 0.0000922 | Pa×s | 701.00 | Joback Calculated Property |
| η | 0.0000633 | Pa×s | 758.29 | Joback Calculated Property |
| η | 0.0000458 | Pa×s | 815.59 | Joback Calculated Property |
| η | 0.0000345 | Pa×s | 872.88 | Joback Calculated Property |
Similar Compounds
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Sources
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