- InChI
- InChI=1S/C9H12ClN/c1-7(2)11-9-6-4-3-5-8(9)10/h3-7,11H,1-2H3
- InChI Key
- JCRMYLUIMGTZSR-UHFFFAOYSA-N
- Formula
- C9H12ClN
- SMILES
- CC(C)Nc1ccccc1Cl
- Molecular Weight1
- 169.65
- CAS
- 78235-07-1
- 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° | 202.70 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 28.42 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 18.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 49.00 | kJ/mol | Joback Calculated Property |
| log10WS | -3.11 | Crippen Calculated Property | |
| logPoct/wat | 3.160 | Crippen Calculated Property | |
| McVol | 136.130 | ml/mol | McGowan Calculated Property |
| Pc | 3149.09 | kPa | Joback Calculated Property |
| Tboil | 524.14 | K | Joback Calculated Property |
| Tc | 744.97 | K | Joback Calculated Property |
| Tfus | 297.71 | K | Joback Calculated Property |
| Vc | 0.509 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [287.98; 357.10] | J/mol×K | [524.14; 744.97] | 
|
| Cp,gas | 287.98 | J/mol×K | 524.14 | Joback Calculated Property |
| Cp,gas | 301.47 | J/mol×K | 560.94 | Joback Calculated Property |
| Cp,gas | 314.13 | J/mol×K | 597.75 | Joback Calculated Property |
| Cp,gas | 325.98 | J/mol×K | 634.55 | Joback Calculated Property |
| Cp,gas | 337.07 | J/mol×K | 671.36 | Joback Calculated Property |
| Cp,gas | 347.43 | J/mol×K | 708.16 | Joback Calculated Property |
| Cp,gas | 357.10 | J/mol×K | 744.97 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Aniline, 2-chloro-n-isopropyl-.
Sources
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