- InChI
- InChI=1S/C15H28Cl2O2/c1-2-3-4-5-6-7-8-9-10-11-12-15(18)19-13-14(16)17/h14H,2-13H2,1H3
- InChI Key
- NDWBXUPQNOFSNY-UHFFFAOYSA-N
- Formula
- C15H28Cl2O2
- SMILES
- CCCCCCCCCCCCC(=O)OCC(Cl)Cl
- Molecular Weight1
- 311.29
- 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 | 0.8310 | Relay (1.0) Calculated Property | |
| ΔfG° | -184.80 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -712.60 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 42.26 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 89.99 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.12 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.08 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.644 | Crippen Calculated Property | |
| McVol | 254.130 | ml/mol | McGowan Calculated Property |
| Pc | 1394.37 | kPa | Joback Calculated Property |
| Inp | [1981.00; 1998.00] |
|
|
| Inp | 1981.00 | NIST | |
| Inp | 1986.00 | NIST | |
| Inp | 1992.00 | NIST | |
| Inp | 1998.00 | NIST | |
| Inp | 1993.00 | NIST | |
| Inp | 1981.00 | NIST | |
| Inp | 1993.00 | NIST | |
| I | [2456.00; 2491.00] |
|
|
| I | 2456.00 | NIST | |
| I | 2457.00 | NIST | |
| I | 2476.00 | NIST | |
| I | 2479.00 | NIST | |
| I | 2491.00 | NIST | |
| I | 2467.00 | NIST | |
| I | 2467.00 | NIST | |
| I | 2456.00 | NIST | |
| Tboil | 584.19 | K | Relay (1.0) Calculated Property |
| Tc | 775.16 | K | Relay (1.0) Calculated Property |
| Tfus | 291.16 | K | Relay (1.0) Calculated Property |
| Vc | 0.956 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [687.83; 772.87] | J/mol×K | [693.31; 872.65] |
|
| Cp,gas | 687.83 | J/mol×K | 693.31 | Joback Calculated Property |
| Cp,gas | 703.92 | J/mol×K | 723.20 | Joback Calculated Property |
| Cp,gas | 719.22 | J/mol×K | 753.09 | Joback Calculated Property |
| Cp,gas | 733.75 | J/mol×K | 782.98 | Joback Calculated Property |
| Cp,gas | 747.52 | J/mol×K | 812.87 | Joback Calculated Property |
| Cp,gas | 760.55 | J/mol×K | 842.76 | Joback Calculated Property |
| Cp,gas | 772.87 | J/mol×K | 872.65 | Joback Calculated Property |
| η | [0.0001030; 0.0020942] | Pa×s | [375.81; 693.31] |
|
| η | 0.0020942 | Pa×s | 375.81 | Joback Calculated Property |
| η | 0.0009300 | Pa×s | 428.73 | Joback Calculated Property |
| η | 0.0004936 | Pa×s | 481.64 | Joback Calculated Property |
| η | 0.0002970 | Pa×s | 534.56 | Joback Calculated Property |
| η | 0.0001959 | Pa×s | 587.48 | Joback Calculated Property |
| η | 0.0001383 | Pa×s | 640.39 | Joback Calculated Property |
| η | 0.0001030 | Pa×s | 693.31 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,2-dichloroethyl tridecanoate.
Sources
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