- InChI
- InChI=1S/C23H42Cl2O4/c24-18-11-7-3-1-2-5-9-13-20-28-22(26)16-15-17-23(27)29-21-14-10-6-4-8-12-19-25/h1-21H2
- InChI Key
- FOFRDBGBNCCSAN-UHFFFAOYSA-N
- Formula
- C23H42Cl2O4
- SMILES
-
O=C(CCCC(=O)OCCCCCCCCCCCl)OCCC
CCCCCCl - Molecular Weight1
- 453.48
- 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° | -348.92 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1039.13 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 69.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 93.87 | kJ/mol | Joback Calculated Property |
| log10WS | -7.48 | Crippen Calculated Property | |
| logPoct/wat | 7.182 | Crippen Calculated Property | |
| McVol | 374.290 | ml/mol | McGowan Calculated Property |
| Pc | 861.00 | kPa | Joback Calculated Property |
| Inp | [3303.00; 3303.00] |
|
|
| Inp | 3303.00 | NIST | |
| Inp | 3303.00 | NIST | |
| Tboil | 953.08 | K | Joback Calculated Property |
| Tc | 1169.74 | K | Joback Calculated Property |
| Tfus | 553.13 | K | Joback Calculated Property |
| Vc | 1.470 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1214.65; 1300.62] | J/mol×K | [953.08; 1169.74] |
|
| Cp,gas | 1214.65 | J/mol×K | 953.08 | Joback Calculated Property |
| Cp,gas | 1232.45 | J/mol×K | 989.19 | Joback Calculated Property |
| Cp,gas | 1248.81 | J/mol×K | 1025.30 | Joback Calculated Property |
| Cp,gas | 1263.76 | J/mol×K | 1061.41 | Joback Calculated Property |
| Cp,gas | 1277.35 | J/mol×K | 1097.52 | Joback Calculated Property |
| Cp,gas | 1289.62 | J/mol×K | 1133.63 | Joback Calculated Property |
| Cp,gas | 1300.62 | J/mol×K | 1169.74 | Joback Calculated Property |
| η | [0.0000241; 0.0003575] | Pa×s | [553.13; 953.08] |
|
| η | 0.0003575 | Pa×s | 553.13 | Joback Calculated Property |
| η | 0.0001791 | Pa×s | 619.79 | Joback Calculated Property |
| η | 0.0001026 | Pa×s | 686.45 | Joback Calculated Property |
| η | 0.0000649 | Pa×s | 753.11 | Joback Calculated Property |
| η | 0.0000442 | Pa×s | 819.76 | Joback Calculated Property |
| η | 0.0000319 | Pa×s | 886.42 | Joback Calculated Property |
| η | 0.0000241 | Pa×s | 953.08 | Joback Calculated Property |
Similar Compounds
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Sources
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