- InChI
- InChI=1S/C6H4Cl2/c7-5-1-2-6(8)4-3-5/h1-4H/i1D,2D,3D,4D
- InChI Key
- OCJBOOLMMGQPQU-RHQRLBAQSA-N
- Formula
- C6D4Cl2
- SMILES
- Clc1ccc(Cl)cc1
- Molecular Weight1
- 151.03
- CAS
- 3855-82-1
- Other Names
-
- 1,4-Dichloro-2,3,5,6-tetradeuterobenzene
- Benzene, 1,4-dichloro-, [2H4]
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 78.56 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 26.41 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 13.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 40.66 | kJ/mol | Joback Calculated Property |
| log10WS | -2.84 | Crippen Calculated Property | |
| logPoct/wat | 2.993 | Crippen Calculated Property | |
| McVol | 96.120 | ml/mol | McGowan Calculated Property |
| Pc | 4151.61 | kPa | Joback Calculated Property |
| Inp | [161.50; 161.50] |
|
|
| Inp | 161.50 | NIST | |
| Inp | 161.50 | NIST | |
| Tboil | 443.20 | K | Joback Calculated Property |
| Tc | 674.86 | K | Joback Calculated Property |
| Tfus | 256.16 | K | Joback Calculated Property |
| Vc | 0.361 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [149.05; 190.77] | J/mol×K | [443.20; 674.86] |
|
| Cp,gas | 149.05 | J/mol×K | 443.20 | Joback Calculated Property |
| Cp,gas | 157.36 | J/mol×K | 481.81 | Joback Calculated Property |
| Cp,gas | 165.09 | J/mol×K | 520.42 | Joback Calculated Property |
| Cp,gas | 172.26 | J/mol×K | 559.03 | Joback Calculated Property |
| Cp,gas | 178.92 | J/mol×K | 597.64 | Joback Calculated Property |
| Cp,gas | 185.08 | J/mol×K | 636.25 | Joback Calculated Property |
| Cp,gas | 190.77 | J/mol×K | 674.86 | Joback Calculated Property |
| η | [0.0002989; 0.0021588] | Pa×s | [256.16; 443.20] |
|
| η | 0.0021588 | Pa×s | 256.16 | Joback Calculated Property |
| η | 0.0012985 | Pa×s | 287.33 | Joback Calculated Property |
| η | 0.0008628 | Pa×s | 318.51 | Joback Calculated Property |
| η | 0.0006166 | Pa×s | 349.68 | Joback Calculated Property |
| η | 0.0004656 | Pa×s | 380.85 | Joback Calculated Property |
| η | 0.0003668 | Pa×s | 412.03 | Joback Calculated Property |
| η | 0.0002989 | Pa×s | 443.20 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,4-Dichlorobenzene-D4.
Sources
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