- InChI
- InChI=1S/C14H20ClNO/c1-3-4-5-6-7-14(17)16-12-9-8-11(2)13(15)10-12/h8-10H,3-7H2,1-2H3,(H,16,17)
- InChI Key
- JHJJKXRETOKFNP-UHFFFAOYSA-N
- Formula
- C14H20ClNO
- SMILES
- CCCCCCC(=O)Nc1ccc(C)c(Cl)c1
- Molecular Weight1
- 253.77
- 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° | 108.69 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -193.55 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 36.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.92 | kJ/mol | Joback Calculated Property |
| log10WS | -4.93 | Crippen Calculated Property | |
| logPoct/wat | 4.557 | Crippen Calculated Property | |
| McVol | 208.150 | ml/mol | McGowan Calculated Property |
| Pc | 2025.41 | kPa | Joback Calculated Property |
| Inp | 2132.00 | NIST | |
| Tboil | 697.83 | K | Joback Calculated Property |
| Tc | 905.24 | K | Joback Calculated Property |
| Tfus | 431.51 | K | Joback Calculated Property |
| Vc | 0.801 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [549.39; 625.48] | J/mol×K | [697.83; 905.24] | 
|
| Cp,gas | 549.39 | J/mol×K | 697.83 | Joback Calculated Property |
| Cp,gas | 564.19 | J/mol×K | 732.40 | Joback Calculated Property |
| Cp,gas | 578.10 | J/mol×K | 766.97 | Joback Calculated Property |
| Cp,gas | 591.15 | J/mol×K | 801.53 | Joback Calculated Property |
| Cp,gas | 603.37 | J/mol×K | 836.10 | Joback Calculated Property |
| Cp,gas | 614.80 | J/mol×K | 870.67 | Joback Calculated Property |
| Cp,gas | 625.48 | J/mol×K | 905.24 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3'-chloro,4'-methylenanthoanilide.
Sources
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