- InChI
- InChI=1S/C23H42Cl2O4/c1-2-3-4-5-6-7-10-13-16-19-28-22(26)17-14-11-8-9-12-15-18-23(27)29-20-21(24)25/h21H,2-20H2,1H3
- InChI Key
- BQHLNJZKTOPKFN-UHFFFAOYSA-N
- Formula
- C23H42Cl2O4
- SMILES
-
CCCCCCCCCCCOC(=O)CCCCCCCCC(=O)
OCC(Cl)Cl - Molecular Weight1
- 453.48
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 1.1854 | Relay (1.0) Calculated Property | |
| ΔfG° | -351.36 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1173.56 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 65.77 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 121.54 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.98 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.16 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.528 | Crippen Calculated Property | |
| McVol | 374.290 | ml/mol | McGowan Calculated Property |
| Pc | 865.05 | kPa | Joback Calculated Property |
| Inp | [3043.00; 3043.00] |
|
|
| Inp | 3043.00 | NIST | |
| Inp | 3043.00 | NIST | |
| Tboil | 657.31 | K | Relay (1.0) Calculated Property |
| Tc | 843.76 | K | Relay (1.0) Calculated Property |
| Tfus | 315.89 | K | Relay (1.0) Calculated Property |
| Vc | 1.420 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1215.05; 1300.28] | J/mol×K | [952.64; 1168.33] |
|
| Cp,gas | 1215.05 | J/mol×K | 952.64 | Joback Calculated Property |
| Cp,gas | 1232.73 | J/mol×K | 988.59 | Joback Calculated Property |
| Cp,gas | 1248.97 | J/mol×K | 1024.54 | Joback Calculated Property |
| Cp,gas | 1263.80 | J/mol×K | 1060.49 | Joback Calculated Property |
| Cp,gas | 1277.27 | J/mol×K | 1096.43 | Joback Calculated Property |
| Cp,gas | 1289.41 | J/mol×K | 1132.38 | Joback Calculated Property |
| Cp,gas | 1300.28 | J/mol×K | 1168.33 | Joback Calculated Property |
| η | [0.0000220; 0.0004012] | Pa×s | [538.13; 952.64] |
|
| η | 0.0004012 | Pa×s | 538.13 | Joback Calculated Property |
| η | 0.0001877 | Pa×s | 607.22 | Joback Calculated Property |
| η | 0.0001026 | Pa×s | 676.30 | Joback Calculated Property |
| η | 0.0000627 | Pa×s | 745.38 | Joback Calculated Property |
| η | 0.0000416 | Pa×s | 814.47 | Joback Calculated Property |
| η | 0.0000295 | Pa×s | 883.55 | Joback Calculated Property |
| η | 0.0000220 | Pa×s | 952.64 | Joback Calculated Property |
Similar Compounds
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Sources
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