- InChI
- InChI=1S/C6H4Cl2N2O2/c7-3-1-4(8)6(9)5(2-3)10(11)12/h1-2H,9H2
- InChI Key
- IZEZAMILKKYOPW-UHFFFAOYSA-N
- Formula
- C6H4Cl2N2O2
- SMILES
- Nc1c(Cl)cc(Cl)cc1[N+](=O)[O-]
- Molecular Weight1
- 207.01
- CAS
- 2683-43-4
- Other Names
-
- 4,6-Dichloro-2-nitroaniline
- Benzenamine, 2,4-dichloro-6-nitro-
- ω : Acentric Factor.
- 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).
- 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).
- 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 | 0.6001 | Relay (1.0) Calculated Property | |
| ΔfG° | 161.30 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 20.85 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 29.12 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 76.13 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.60 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.71 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.484 | Crippen Calculated Property | |
| McVol | 123.520 | ml/mol | McGowan Calculated Property |
| Pc | 4368.40 | kPa | Joback Calculated Property |
| Tboil | 566.39 | K | Relay (1.0) Calculated Property |
| Tc | 861.24 | K | Relay (1.0) Calculated Property |
| Tfus | 397.88 | K | Relay (1.0) Calculated Property |
| Vc | 0.422 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [260.08; 295.51] | J/mol×K | [677.53; 948.30] | 
|
| Cp,gas | 260.08 | J/mol×K | 677.53 | Joback Calculated Property |
| Cp,gas | 267.57 | J/mol×K | 722.66 | Joback Calculated Property |
| Cp,gas | 274.37 | J/mol×K | 767.79 | Joback Calculated Property |
| Cp,gas | 280.54 | J/mol×K | 812.91 | Joback Calculated Property |
| Cp,gas | 286.09 | J/mol×K | 858.04 | Joback Calculated Property |
| Cp,gas | 291.07 | J/mol×K | 903.17 | Joback Calculated Property |
| Cp,gas | 295.51 | J/mol×K | 948.30 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,4-Dichloro-6-nitroaniline.
Sources
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