- InChI
- InChI=1S/C18H28Cl2O/c1-2-3-4-5-6-7-8-9-10-13-21-15-16-11-12-17(19)14-18(16)20/h11-12,14H,2-10,13,15H2,1H3
- InChI Key
- OSOLFCOGEAVEPG-UHFFFAOYSA-N
- Formula
- C18H28Cl2O
- SMILES
- CCCCCCCCCCCOCc1ccc(Cl)cc1Cl
- Molecular Weight1
- 331.33
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- 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 | 0.8402 | Relay (1.0) Calculated Property | |
| ΔfusH° | 45.22 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 101.29 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 7.041 | Crippen Calculated Property | |
| McVol | 271.070 | ml/mol | McGowan Calculated Property |
| Pc | 1335.88 | kPa | Joback Calculated Property |
| Inp | [2274.00; 2287.00] |
|
|
| Inp | 2275.00 | NIST | |
| Inp | 2280.00 | NIST | |
| Inp | 2284.00 | NIST | |
| Inp | 2287.00 | NIST | |
| Inp | 2275.00 | NIST | |
| Inp | 2281.00 | NIST | |
| Inp | 2284.00 | NIST | |
| Inp | 2287.00 | NIST | |
| Inp | 2274.00 | NIST | |
| Inp | 2280.00 | NIST | |
| Inp | 2284.00 | NIST | |
| Inp | 2287.00 | NIST | |
| Tboil | 618.90 | K | Relay (1.0) Calculated Property |
| Tc | 833.44 | K | Relay (1.0) Calculated Property |
| Tfus | 280.10 | K | Relay (1.0) Calculated Property |
| Vc | 1.017 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [749.57; 837.54] | J/mol×K | [745.36; 940.26] |
|
| Cp,gas | 749.57 | J/mol×K | 745.36 | Joback Calculated Property |
| Cp,gas | 766.51 | J/mol×K | 777.84 | Joback Calculated Property |
| Cp,gas | 782.51 | J/mol×K | 810.33 | Joback Calculated Property |
| Cp,gas | 797.58 | J/mol×K | 842.81 | Joback Calculated Property |
| Cp,gas | 811.75 | J/mol×K | 875.29 | Joback Calculated Property |
| Cp,gas | 825.06 | J/mol×K | 907.77 | Joback Calculated Property |
| Cp,gas | 837.54 | J/mol×K | 940.26 | Joback Calculated Property |
| η | [0.0000772; 0.0008615] | Pa×s | [426.15; 745.36] |
|
| η | 0.0008615 | Pa×s | 426.15 | Joback Calculated Property |
| η | 0.0004610 | Pa×s | 479.35 | Joback Calculated Property |
| η | 0.0002795 | Pa×s | 532.55 | Joback Calculated Property |
| η | 0.0001856 | Pa×s | 585.75 | Joback Calculated Property |
| η | 0.0001319 | Pa×s | 638.96 | Joback Calculated Property |
| η | 0.0000988 | Pa×s | 692.16 | Joback Calculated Property |
| η | 0.0000772 | Pa×s | 745.36 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,4-dichlorobenzyl undecyl ether.
Sources
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