- InChI
- InChI=1S/C27H50Cl2O4/c1-2-3-4-5-6-7-8-9-10-11-14-17-20-23-32-26(30)21-18-15-12-13-16-19-22-27(31)33-24-25(28)29/h25H,2-24H2,1H3
- InChI Key
- VAKDUWZYDMTKEF-UHFFFAOYSA-N
- Formula
- C27H50Cl2O4
- SMILES
-
CCCCCCCCCCCCCCCOC(=O)CCCCCCCCC
(=O)OCC(Cl)Cl - Molecular Weight1
- 509.59
- 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 | 1.3260 | Relay (1.0) Calculated Property | |
| ΔfG° | -317.68 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1254.95 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 76.13 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 137.04 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.10 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.41 | Relay (1.0) Calculated Property | |
| logPoct/wat | 9.089 | Crippen Calculated Property | |
| McVol | 430.650 | ml/mol | McGowan Calculated Property |
| Pc | 698.39 | kPa | Joback Calculated Property |
| Inp | 3458.00 | NIST | |
| Tboil | 683.17 | K | Relay (1.0) Calculated Property |
| Tc | 868.60 | K | Relay (1.0) Calculated Property |
| Tfus | 324.89 | K | Relay (1.0) Calculated Property |
| Vc | 1.640 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1467.32; 1556.78] | J/mol×K | [1044.16; 1298.76] | 
|
| Cp,gas | 1467.32 | J/mol×K | 1044.16 | Joback Calculated Property |
| Cp,gas | 1487.13 | J/mol×K | 1086.59 | Joback Calculated Property |
| Cp,gas | 1504.86 | J/mol×K | 1129.03 | Joback Calculated Property |
| Cp,gas | 1520.59 | J/mol×K | 1171.46 | Joback Calculated Property |
| Cp,gas | 1534.43 | J/mol×K | 1213.89 | Joback Calculated Property |
| Cp,gas | 1546.46 | J/mol×K | 1256.32 | Joback Calculated Property |
| Cp,gas | 1556.78 | J/mol×K | 1298.76 | Joback Calculated Property |
| η | [0.0000115; 0.0002316] | Pa×s | [583.21; 1044.16] |
|
| η | 0.0002316 | Pa×s | 583.21 | Joback Calculated Property |
| η | 0.0001049 | Pa×s | 660.03 | Joback Calculated Property |
| η | 0.0000560 | Pa×s | 736.86 | Joback Calculated Property |
| η | 0.0000337 | Pa×s | 813.68 | Joback Calculated Property |
| η | 0.0000221 | Pa×s | 890.51 | Joback Calculated Property |
| η | 0.0000155 | Pa×s | 967.33 | Joback Calculated Property |
| η | 0.0000115 | Pa×s | 1044.16 | Joback Calculated Property |
Similar Compounds
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Sources
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