- InChI
- InChI=1S/C16H24Cl2O/c1-2-3-4-5-6-7-8-11-19-13-14-9-10-15(17)12-16(14)18/h9-10,12H,2-8,11,13H2,1H3
- InChI Key
- DVNQUGQEDVPWHU-UHFFFAOYSA-N
- Formula
- C16H24Cl2O
- SMILES
- CCCCCCCCCOCc1ccc(Cl)cc1Cl
- Molecular Weight1
- 303.27
- 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 | 0.7654 | Relay (1.0) Calculated Property | |
| ΔfusH° | 40.04 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 92.29 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 6.261 | Crippen Calculated Property | |
| McVol | 242.890 | ml/mol | McGowan Calculated Property |
| Pc | 1545.13 | kPa | Joback Calculated Property |
| Inp | [2067.00; 2079.00] |
|
|
| Inp | 2067.00 | NIST | |
| Inp | 2072.00 | NIST | |
| Inp | 2075.00 | NIST | |
| Inp | 2079.00 | NIST | |
| Inp | 2068.00 | NIST | |
| Inp | 2073.00 | NIST | |
| Inp | 2076.00 | NIST | |
| Inp | 2078.00 | NIST | |
| Inp | 2067.00 | NIST | |
| Inp | 2072.00 | NIST | |
| Inp | 2076.00 | NIST | |
| Inp | 2078.00 | NIST | |
| Tboil | 603.18 | K | Relay (1.0) Calculated Property |
| Tc | 816.78 | K | Relay (1.0) Calculated Property |
| Tfus | 271.49 | K | Relay (1.0) Calculated Property |
| Vc | 0.906 | 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.
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [334.96; 755.22] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | 3.43190e+01 | |||
| Coefficient B | 1.27632e+00 | |||
| Coefficient C | -6.73520e-04 | |||
| Coefficient D | 1.18100e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 334.96 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 406.79 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 471.46 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 529.35 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 580.83 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 626.28 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 666.07 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 700.58 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 730.17 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 755.22 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0010085; 0.0001421] | Pa×s | [403.61; 628.20] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -1.23814e+01 | |||
| Coefficient B | 2.21263e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 403.61 | |||
| Temperature range, max. | 628.20 | |||
| η | 0.0010085 | Pa×s | 403.61 | Calculated Property |
| η | 0.0007329 | Pa×s | 428.56 | Calculated Property |
| η | 0.0005517 | Pa×s | 453.52 | Calculated Property |
| η | 0.0004277 | Pa×s | 478.47 | Calculated Property |
| η | 0.0003401 | Pa×s | 503.43 | Calculated Property |
| η | 0.0002764 | Pa×s | 528.38 | Calculated Property |
| η | 0.0002288 | Pa×s | 553.34 | Calculated Property |
| η | 0.0001925 | Pa×s | 578.29 | Calculated Property |
| η | 0.0001644 | Pa×s | 603.25 | Calculated Property |
| η | 0.0001421 | Pa×s | 628.20 | Calculated Property |
Similar Compounds
Find more compounds similar to 2,4-dichlorobenzyl nonyl ether.
Sources
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