- InChI
- InChI=1S/C8H9Cl2N/c9-7-2-1-6(3-4-11)8(10)5-7/h1-2,5H,3-4,11H2
- InChI Key
- VHJKDOLGYMULOP-UHFFFAOYSA-N
- Formula
- C8H9Cl2N
- SMILES
- NCCc1ccc(Cl)cc1Cl
- Molecular Weight1
- 190.07
- CAS
- 52516-13-9
- 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° | 152.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 7.45 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 23.33 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.41 | kJ/mol | Joback Calculated Property |
| log10WS | -3.08 | Crippen Calculated Property | |
| logPoct/wat | 2.495 | Crippen Calculated Property | |
| McVol | 134.280 | ml/mol | McGowan Calculated Property |
| Pc | 3452.08 | kPa | Joback Calculated Property |
| Tboil | 566.47 | K | Joback Calculated Property |
| Tc | 801.63 | K | Joback Calculated Property |
| Tfus | 374.48 | K | Joback Calculated Property |
| Vc | 0.502 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [276.02; 330.07] | J/mol×K | [566.47; 801.63] | 
|
| Cp,gas | 276.02 | J/mol×K | 566.47 | Joback Calculated Property |
| Cp,gas | 286.70 | J/mol×K | 605.66 | Joback Calculated Property |
| Cp,gas | 296.67 | J/mol×K | 644.86 | Joback Calculated Property |
| Cp,gas | 305.96 | J/mol×K | 684.05 | Joback Calculated Property |
| Cp,gas | 314.60 | J/mol×K | 723.24 | Joback Calculated Property |
| Cp,gas | 322.63 | J/mol×K | 762.44 | Joback Calculated Property |
| Cp,gas | 330.07 | J/mol×K | 801.63 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,4-Dichlorophenethylamine.
Sources
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