- InChI
- InChI=1S/C11H14ClNO/c1-2-3-7-11(14)13-10-6-4-5-9(12)8-10/h4-6,8H,2-3,7H2,1H3,(H,13,14)
- InChI Key
- LOQKNLXBLMIZPG-UHFFFAOYSA-N
- Formula
- C11H14ClNO
- SMILES
- CCCCC(=O)Nc1cccc(Cl)c1
- Molecular Weight1
- 211.69
- 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° | 93.06 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -120.16 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 28.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.59 | kJ/mol | Joback Calculated Property |
| log10WS | -3.62 | Crippen Calculated Property | |
| logPoct/wat | 3.469 | Crippen Calculated Property | |
| McVol | 165.880 | ml/mol | McGowan Calculated Property |
| Pc | 2715.50 | kPa | Joback Calculated Property |
| Inp | 1817.00 | NIST | |
| Tboil | 624.21 | K | Joback Calculated Property |
| Tc | 840.51 | K | Joback Calculated Property |
| Tfus | 385.18 | K | Joback Calculated Property |
| Vc | 0.633 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [397.23; 465.27] | J/mol×K | [624.21; 840.51] | 
|
| Cp,gas | 397.23 | J/mol×K | 624.21 | Joback Calculated Property |
| Cp,gas | 410.59 | J/mol×K | 660.26 | Joback Calculated Property |
| Cp,gas | 423.10 | J/mol×K | 696.31 | Joback Calculated Property |
| Cp,gas | 434.78 | J/mol×K | 732.36 | Joback Calculated Property |
| Cp,gas | 445.68 | J/mol×K | 768.41 | Joback Calculated Property |
| Cp,gas | 455.83 | J/mol×K | 804.46 | Joback Calculated Property |
| Cp,gas | 465.27 | J/mol×K | 840.51 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Pentanamide, N-(3-chlorophenyl)-.
Sources
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