- InChI
- InChI=1S/C27H42Cl2O4/c1-2-3-4-5-6-9-12-15-20-32-26(30)16-13-10-7-8-11-14-17-27(31)33-22-23-21-24(28)18-19-25(23)29/h18-19,21H,2-17,20,22H2,1H3
- InChI Key
- UMLBKMKXGAPJNY-UHFFFAOYSA-N
- Formula
- C27H42Cl2O4
- SMILES
-
CCCCCCCCCCOC(=O)CCCCCCCCC(=O)O
Cc1cc(Cl)ccc1Cl - Molecular Weight1
- 501.53
- 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° | -222.09 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -908.10 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 72.92 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 106.38 | kJ/mol | Joback Calculated Property |
| log10WS | -9.82 | Crippen Calculated Property | |
| logPoct/wat | 8.841 | Crippen Calculated Property | |
| McVol | 406.890 | ml/mol | McGowan Calculated Property |
| Pc | 820.54 | kPa | Joback Calculated Property |
| Inp | [3498.00; 3498.00] |
|
|
| Inp | 3498.00 | NIST | |
| Inp | 3498.00 | NIST | |
| Tboil | 1081.24 | K | Joback Calculated Property |
| Tc | 1331.71 | K | Joback Calculated Property |
| Tfus | 649.67 | K | Joback Calculated Property |
| Vc | 1.585 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1354.70; 1420.56] | J/mol×K | [1081.24; 1331.71] |
|
| Cp,gas | 1354.70 | J/mol×K | 1081.24 | Joback Calculated Property |
| Cp,gas | 1370.04 | J/mol×K | 1122.98 | Joback Calculated Property |
| Cp,gas | 1383.53 | J/mol×K | 1164.73 | Joback Calculated Property |
| Cp,gas | 1395.25 | J/mol×K | 1206.47 | Joback Calculated Property |
| Cp,gas | 1405.28 | J/mol×K | 1248.22 | Joback Calculated Property |
| Cp,gas | 1413.69 | J/mol×K | 1289.96 | Joback Calculated Property |
| Cp,gas | 1420.56 | J/mol×K | 1331.71 | Joback Calculated Property |
| η | [0.0000139; 0.0001493] | Pa×s | [649.67; 1081.24] |
|
| η | 0.0001493 | Pa×s | 649.67 | Joback Calculated Property |
| η | 0.0000825 | Pa×s | 721.60 | Joback Calculated Property |
| η | 0.0000508 | Pa×s | 793.53 | Joback Calculated Property |
| η | 0.0000339 | Pa×s | 865.45 | Joback Calculated Property |
| η | 0.0000241 | Pa×s | 937.38 | Joback Calculated Property |
| η | 0.0000179 | Pa×s | 1009.31 | Joback Calculated Property |
| η | 0.0000139 | Pa×s | 1081.24 | Joback Calculated Property |
Similar Compounds
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Sources
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