- InChI
- InChI=1S/C16H24ClNO/c1-3-4-5-6-7-8-9-16(19)18-14-11-10-13(2)15(17)12-14/h10-12H,3-9H2,1-2H3,(H,18,19)
- InChI Key
- UWVWDJSGXYBBLV-UHFFFAOYSA-N
- Formula
- C16H24ClNO
- SMILES
- CCCCCCCCC(=O)Nc1ccc(C)c(Cl)c1
- Molecular Weight1
- 281.82
- 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).
- 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 |
|---|---|---|---|
| ω | 0.8109 | Relay (1.0) Calculated Property | |
| ΔfG° | 125.53 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -344.18 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 41.35 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 90.85 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.19 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.76 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.338 | Crippen Calculated Property | |
| McVol | 236.330 | ml/mol | McGowan Calculated Property |
| Pc | 1716.03 | kPa | Joback Calculated Property |
| Inp | 2329.00 | NIST | |
| Tboil | 614.07 | K | Relay (1.0) Calculated Property |
| Tc | 865.75 | K | Relay (1.0) Calculated Property |
| Tfus | 354.76 | K | Relay (1.0) Calculated Property |
| Vc | 0.869 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [657.88; 738.01] | J/mol×K | [743.59; 946.46] | 
|
| Cp,gas | 657.88 | J/mol×K | 743.59 | Joback Calculated Property |
| Cp,gas | 673.44 | J/mol×K | 777.40 | Joback Calculated Property |
| Cp,gas | 688.07 | J/mol×K | 811.21 | Joback Calculated Property |
| Cp,gas | 701.80 | J/mol×K | 845.02 | Joback Calculated Property |
| Cp,gas | 714.68 | J/mol×K | 878.84 | Joback Calculated Property |
| Cp,gas | 726.73 | J/mol×K | 912.65 | Joback Calculated Property |
| Cp,gas | 738.01 | J/mol×K | 946.46 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3'-chloro,4'-methylpelargoanilide.
Sources
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