- InChI
- InChI=1S/C14H20Cl2O/c1-2-3-4-5-6-9-17-11-12-7-8-13(15)10-14(12)16/h7-8,10H,2-6,9,11H2,1H3
- InChI Key
- GQMGSURHBCAFJD-UHFFFAOYSA-N
- Formula
- C14H20Cl2O
- SMILES
- CCCCCCCOCc1ccc(Cl)cc1Cl
- Molecular Weight1
- 275.21
- 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 | 0.6841 | Relay (1.0) Calculated Property | |
| ΔfusH° | 34.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 83.69 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 5.480 | Crippen Calculated Property | |
| McVol | 214.710 | ml/mol | McGowan Calculated Property |
| Pc | 1807.70 | kPa | Joback Calculated Property |
| Inp | [1860.00; 1873.00] |
|
|
| Inp | 1862.00 | NIST | |
| Inp | 1866.00 | NIST | |
| Inp | 1869.00 | NIST | |
| Inp | 1872.00 | NIST | |
| Inp | 1866.00 | NIST | |
| Inp | 1867.00 | NIST | |
| Inp | 1871.00 | NIST | |
| Inp | 1873.00 | NIST | |
| Inp | 1860.00 | NIST | |
| Inp | 1865.00 | NIST | |
| Inp | 1869.00 | NIST | |
| Inp | 1870.00 | NIST | |
| Inp | 1862.00 | NIST | |
| Inp | 1867.00 | NIST | |
| Inp | 1869.00 | NIST | |
| Tboil | 583.26 | K | Relay (1.0) Calculated Property |
| Tc | 797.22 | K | Relay (1.0) Calculated Property |
| Tfus | 262.78 | K | Relay (1.0) Calculated Property |
| Vc | 0.795 | 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 | [292.53; 652.04] | 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 | 3.61370e+01 | |||
| Coefficient B | 1.08632e+00 | |||
| Coefficient C | -5.64720e-04 | |||
| Coefficient D | 9.43000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 292.53 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 353.95 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 409.30 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 458.89 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 503.01 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 541.96 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 576.04 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 605.55 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 630.78 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 652.04 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0011497; 0.0001660] | Pa×s | [381.07; 599.43] |
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 | -1.20804e+01 | |||
| Coefficient B | 2.02431e+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. | 381.07 | |||
| Temperature range, max. | 599.43 | |||
| η | 0.0011497 | Pa×s | 381.07 | Calculated Property |
| η | 0.0008365 | Pa×s | 405.33 | Calculated Property |
| η | 0.0006309 | Pa×s | 429.59 | Calculated Property |
| η | 0.0004904 | Pa×s | 453.86 | Calculated Property |
| η | 0.0003911 | Pa×s | 478.12 | Calculated Property |
| η | 0.0003188 | Pa×s | 502.38 | Calculated Property |
| η | 0.0002648 | Pa×s | 526.64 | Calculated Property |
| η | 0.0002235 | Pa×s | 550.91 | Calculated Property |
| η | 0.0001914 | Pa×s | 575.17 | Calculated Property |
| η | 0.0001660 | Pa×s | 599.43 | Calculated Property |
Similar Compounds
Find more compounds similar to 2,4-dichlorobenzyl heptyl ether.
Sources
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