- InChI
- InChI=1S/C10H12ClNO/c1-3-10(13)12-8-5-4-7(2)9(11)6-8/h4-6H,3H2,1-2H3,(H,12,13)
- InChI Key
- DJKZTHGBRJVGNO-UHFFFAOYSA-N
- Formula
- C10H12ClNO
- SMILES
- CCC(=O)Nc1ccc(C)c(Cl)c1
- Molecular Weight1
- 197.66
- 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).
- 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° | 75.01 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -110.99 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 25.81 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 59.02 | kJ/mol | Joback Calculated Property |
| log10WS | -3.25 | Crippen Calculated Property | |
| logPoct/wat | 2.997 | Crippen Calculated Property | |
| McVol | 151.790 | ml/mol | McGowan Calculated Property |
| Pc | 2960.12 | kPa | Joback Calculated Property |
| Inp | 1736.00 | NIST | |
| Tboil | 606.31 | K | Joback Calculated Property |
| Tc | 827.43 | K | Joback Calculated Property |
| Tfus | 386.43 | K | Joback Calculated Property |
| Vc | 0.578 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [348.25; 411.60] | J/mol×K | [606.31; 827.43] | 
|
| Cp,gas | 348.25 | J/mol×K | 606.31 | Joback Calculated Property |
| Cp,gas | 360.66 | J/mol×K | 643.16 | Joback Calculated Property |
| Cp,gas | 372.29 | J/mol×K | 680.02 | Joback Calculated Property |
| Cp,gas | 383.17 | J/mol×K | 716.87 | Joback Calculated Property |
| Cp,gas | 393.33 | J/mol×K | 753.72 | Joback Calculated Property |
| Cp,gas | 402.80 | J/mol×K | 790.58 | Joback Calculated Property |
| Cp,gas | 411.60 | J/mol×K | 827.43 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3'-chloro,4'-methylpropioanilide.
Sources
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