- InChI
- InChI=1S/C19H31NO3/c1-3-4-5-6-7-8-9-10-11-16-23-19(21)20-17-12-14-18(22-2)15-13-17/h12-15H,3-11,16H2,1-2H3,(H,20,21)
- InChI Key
- VUKNZGXNSSBZSV-UHFFFAOYSA-N
- Formula
- C19H31NO3
- SMILES
- CCCCCCCCCCCOC(=O)Nc1ccc(OC)cc1
- Molecular Weight1
- 321.45
- CAS
- 95368-51-7
- 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° | -37.65 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -533.98 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 47.69 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.83 | kJ/mol | Joback Calculated Property |
| log10WS | -6.05 | Crippen Calculated Property | |
| logPoct/wat | 5.774 | Crippen Calculated Property | |
| McVol | 278.100 | ml/mol | McGowan Calculated Property |
| Pc | 1388.15 | kPa | Joback Calculated Property |
| Tboil | 814.66 | K | Joback Calculated Property |
| Tc | 1010.45 | K | Joback Calculated Property |
| Tfus | 489.88 | K | Joback Calculated Property |
| Vc | 1.069 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [859.44; 944.51] | J/mol×K | [814.66; 1010.45] | 
|
| Cp,gas | 859.44 | J/mol×K | 814.66 | Joback Calculated Property |
| Cp,gas | 876.26 | J/mol×K | 847.29 | Joback Calculated Property |
| Cp,gas | 891.99 | J/mol×K | 879.92 | Joback Calculated Property |
| Cp,gas | 906.65 | J/mol×K | 912.55 | Joback Calculated Property |
| Cp,gas | 920.28 | J/mol×K | 945.18 | Joback Calculated Property |
| Cp,gas | 932.89 | J/mol×K | 977.81 | Joback Calculated Property |
| Cp,gas | 944.51 | J/mol×K | 1010.45 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to P-methoxy carbanilic acid, n-undecyl ester.
Sources
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