- InChI
- InChI=1S/C6H12Cl2O/c1-5(7)3-9-4-6(2)8/h5-6H,3-4H2,1-2H3
- InChI Key
- LTJNJOSNHALAPB-UHFFFAOYSA-N
- Formula
- C6H12Cl2O
- SMILES
- CC(Cl)COCC(C)Cl
- Molecular Weight1
- 171.07
- Other Names
-
- Propane, 1,1'-oxybis*2-chloro-
- 2,2'-Dichloropropyl propyl ether
- 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.
- 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 | 0.4418 | Relay (1.0) Calculated Property | |
| ΔfG° | -134.10 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -371.67 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 13.83 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 51.70 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.97 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.35 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.258 | Crippen Calculated Property | |
| McVol | 125.750 | ml/mol | McGowan Calculated Property |
| Pc | 2862.74 | kPa | Joback Calculated Property |
| Inp | [1048.00; 1055.00] |
|
|
| Inp | 1048.00 | NIST | |
| Inp | 1055.00 | NIST | |
| Tboil | 456.78 | K | Relay (1.0) Calculated Property |
| Tc | 650.87 | K | Relay (1.0) Calculated Property |
| Tfus | 238.98 | K | Relay (1.0) Calculated Property |
| Vc | 0.449 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [174.35; 364.99] | 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 | 4.53520e+01 | |||
| Coefficient B | 5.36040e-01 | |||
| Coefficient C | -2.38800e-04 | |||
| Coefficient D | 2.24000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 174.35 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 206.09 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 235.03 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 261.24 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 284.78 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 305.73 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 324.15 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 340.12 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 353.71 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 364.99 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0084256; 0.0002531] | Pa×s | [209.45; 435.05] |
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 | -1.15359e+01 | |||
| Coefficient B | 1.41577e+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. | 209.45 | |||
| Temperature range, max. | 435.05 | |||
| η | 0.0084256 | Pa×s | 209.45 | Calculated Property |
| η | 0.0040910 | Pa×s | 234.52 | Calculated Property |
| η | 0.0022838 | Pa×s | 259.58 | Calculated Property |
| η | 0.0014128 | Pa×s | 284.65 | Calculated Property |
| η | 0.0009446 | Pa×s | 309.71 | Calculated Property |
| η | 0.0006708 | Pa×s | 334.78 | Calculated Property |
| η | 0.0004997 | Pa×s | 359.85 | Calculated Property |
| η | 0.0003867 | Pa×s | 384.91 | Calculated Property |
| η | 0.0003088 | Pa×s | 409.98 | Calculated Property |
| η | 0.0002531 | Pa×s | 435.05 | Calculated Property |
Similar Compounds
Find more compounds similar to Bis(2-chloropropyl)ether.
Sources
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