- InChI
- InChI=1S/C14H12Cl2/c15-14(16)13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13-14H
- InChI Key
- FVMUDWLRSAABPN-UHFFFAOYSA-N
- Formula
- C14H12Cl2
- SMILES
- ClC(Cl)C(c1ccccc1)c1ccccc1
- Molecular Weight1
- 251.16
- 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 | 0.4060 | Relay (1.0) Calculated Property | |
| ΔfG° | 263.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 106.26 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 21.45 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.03 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.02 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.45 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.622 | Crippen Calculated Property | |
| McVol | 185.080 | ml/mol | McGowan Calculated Property |
| Pc | 2608.40 | kPa | Joback Calculated Property |
| Inp | [1854.00; 1854.00] |
|
|
| Inp | 1854.00 | NIST | |
| Inp | 1854.00 | NIST | |
| Tboil | 587.77 | K | Relay (1.0) Calculated Property |
| Tc | 848.10 | K | Relay (1.0) Calculated Property |
| Tfus | 337.31 | K | Relay (1.0) Calculated Property |
| Vc | 0.646 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [214.14; 522.17] | 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 | -5.52300e+01 | |||
| Coefficient B | 1.20140e+00 | |||
| Coefficient C | -8.47400e-04 | |||
| Coefficient D | 2.23400e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 214.14 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 273.63 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 325.16 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 369.42 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 407.14 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 439.01 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 465.74 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 488.04 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 506.61 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 522.17 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0032642; 0.0001527] | Pa×s | [330.22; 633.13] |
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 | -1.21259e+01 | |||
| Coefficient B | 2.11380e+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. | 330.22 | |||
| Temperature range, max. | 633.13 | |||
| η | 0.0032642 | Pa×s | 330.22 | Calculated Property |
| η | 0.0018057 | Pa×s | 363.88 | Calculated Property |
| η | 0.0011042 | Pa×s | 397.53 | Calculated Property |
| η | 0.0007291 | Pa×s | 431.19 | Calculated Property |
| η | 0.0005113 | Pa×s | 464.85 | Calculated Property |
| η | 0.0003761 | Pa×s | 498.51 | Calculated Property |
| η | 0.0002876 | Pa×s | 532.16 | Calculated Property |
| η | 0.0002271 | Pa×s | 565.82 | Calculated Property |
| η | 0.0001841 | Pa×s | 599.48 | Calculated Property |
| η | 0.0001527 | Pa×s | 633.13 | Calculated Property |
Similar Compounds
Find more compounds similar to BENZENE, 1,1'-(2,2-DICHLOROETHYLIDENE)BIS-.
Sources
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