- InChI
- InChI=1S/C20H38Cl2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)24-18-19(21)22/h19H,2-18H2,1H3
- InChI Key
- RUPHJTBMXWPBGU-UHFFFAOYSA-N
- Formula
- C20H38Cl2O2
- SMILES
-
CCCCCCCCCCCCCCCCCC(=O)OCC(Cl)C
l - Molecular Weight1
- 381.42
- 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.
- I : 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 | 1.0080 | Relay (1.0) Calculated Property | |
| ΔfG° | -142.70 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -817.76 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 55.21 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 111.06 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.23 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.72 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.595 | Crippen Calculated Property | |
| McVol | 324.580 | ml/mol | McGowan Calculated Property |
| Pc | 1002.71 | kPa | Joback Calculated Property |
| Inp | [2503.00; 2507.00] |
|
|
| Inp | 2503.00 | NIST | |
| Inp | 2507.00 | NIST | |
| Inp | 2507.00 | NIST | |
| I | [2985.00; 2999.00] |
|
|
| I | 2985.00 | NIST | |
| I | 2988.00 | NIST | |
| I | 2999.00 | NIST | |
| I | 2992.00 | NIST | |
| I | 2985.00 | NIST | |
| Tboil | 619.06 | K | Relay (1.0) Calculated Property |
| Tc | 815.34 | K | Relay (1.0) Calculated Property |
| Tfus | 314.55 | K | Relay (1.0) Calculated Property |
| Vc | 1.237 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [978.21; 1072.61] | J/mol×K | [807.71; 992.53] |
|
| Cp,gas | 978.21 | J/mol×K | 807.71 | Joback Calculated Property |
| Cp,gas | 996.33 | J/mol×K | 838.51 | Joback Calculated Property |
| Cp,gas | 1013.45 | J/mol×K | 869.32 | Joback Calculated Property |
| Cp,gas | 1029.61 | J/mol×K | 900.12 | Joback Calculated Property |
| Cp,gas | 1044.83 | J/mol×K | 930.92 | Joback Calculated Property |
| Cp,gas | 1059.15 | J/mol×K | 961.72 | Joback Calculated Property |
| Cp,gas | 1072.61 | J/mol×K | 992.53 | Joback Calculated Property |
| η | [0.0000505; 0.0011963] | Pa×s | [432.16; 807.71] |
|
| η | 0.0011963 | Pa×s | 432.16 | Joback Calculated Property |
| η | 0.0005055 | Pa×s | 494.75 | Joback Calculated Property |
| η | 0.0002592 | Pa×s | 557.34 | Joback Calculated Property |
| η | 0.0001521 | Pa×s | 619.93 | Joback Calculated Property |
| η | 0.0000984 | Pa×s | 682.53 | Joback Calculated Property |
| η | 0.0000685 | Pa×s | 745.12 | Joback Calculated Property |
| η | 0.0000505 | Pa×s | 807.71 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,2-dichloroethyl octadecanoate.
Sources
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