- InChI
- InChI=1S/C12H11ClN2/c13-9-5-7-10(8-6-9)15-12-4-2-1-3-11(12)14/h1-8,15H,14H2
- InChI Key
- WEUBIWJPIRTWDF-UHFFFAOYSA-N
- Formula
- C12H11ClN2
- SMILES
- Nc1ccccc1Nc1ccc(Cl)cc1
- Molecular Weight1
- 218.68
- CAS
- 68817-71-0
- Other Names
-
- 1,2-Benzenediamine, N-(4-chlorophenyl)-
- N-(4-chlorophenyl)benzene-1,2-diamine
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- 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° | 399.63 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 230.63 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 28.63 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.64 | kJ/mol | Joback Calculated Property |
| log10WS | -3.60 | Crippen Calculated Property | |
| logPoct/wat | 3.666 | Crippen Calculated Property | |
| McVol | 164.620 | ml/mol | McGowan Calculated Property |
| Pc | 3439.94 | kPa | Joback Calculated Property |
| Tboil | 697.41 | K | Joback Calculated Property |
| Tc | 955.95 | K | Joback Calculated Property |
| Tfus | 468.72 | K | Joback Calculated Property |
| Vc | 0.605 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [406.30; 468.91] | J/mol×K | [697.41; 955.95] | 
|
| Cp,gas | 406.30 | J/mol×K | 697.41 | Joback Calculated Property |
| Cp,gas | 419.32 | J/mol×K | 740.50 | Joback Calculated Property |
| Cp,gas | 431.21 | J/mol×K | 783.59 | Joback Calculated Property |
| Cp,gas | 442.03 | J/mol×K | 826.68 | Joback Calculated Property |
| Cp,gas | 451.87 | J/mol×K | 869.77 | Joback Calculated Property |
| Cp,gas | 460.80 | J/mol×K | 912.86 | Joback Calculated Property |
| Cp,gas | 468.91 | J/mol×K | 955.95 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to N-(4-Chlorophenyl)-1,2-phenylenediamine.
Sources
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